NS-398 [Ligand Id: 8976] activity data from GtoPdb and ChEMBL
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| ChEMBL ligand: CHEMBL7162 (NS-398) |
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| DB | Assay description | Assay Type | Standard value | Standard parameter | Original value | Original units | Original parameter | Reference |
|---|---|---|---|---|---|---|---|---|
| 5-LOX/Arachidonate 5-lipoxygenase in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL215] [GtoPdb: 1385] [UniProtKB: P09917] | ||||||||
| ChEMBL | The compound was evaluated for its inhibitory activity against 5-lipoxygenase using granulocytes-type cells | B | 5 | pIC50 | >10000 | nM | IC50 | Bioorg Med Chem Lett (2002) 12: 779-782 [PMID:11859001] |
| COX-1 /Cyclooxygenase-1 in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL221] [GtoPdb: 1375] [UniProtKB: P23219] | ||||||||
| ChEMBL | In vitro inhibitory activity against constitutive form of human recombinant cyclooxygenase (COX-1) | B | 4 | pIC50 | >100000 | nM | IC50 | Bioorg Med Chem Lett (1995) 5: 867-872 |
| ChEMBL | Inhibition of COX1-catalyzed prostaglandin biosynthesis 10 mins of preincubation | B | 4 | pIC50 | >100000 | nM | IC50 | J Nat Prod (1998) 61: 1212-1215 [PMID:9784154] |
| ChEMBL | In vitro inhibition of prostaglandin G/H synthase 1. | B | 4 | pIC50 | >100000 | nM | IC50 | J Med Chem (1995) 38: 4570-4578 [PMID:7473585] |
| ChEMBL | Inhibition of COX1 in human whole blood assessed as effect on A-23187-stimulated TxB2 production | B | 4.45 | pIC50 | 35680 | nM | IC50 | Bioorg Med Chem (2008) 16: 2697-2706 [PMID:18063374] |
| ChEMBL | Tested for inhibition against Prostaglandin G/H synthase 1 | B | 5 | pIC50 | >10000 | nM | IC50 | J Med Chem (1994) 37: 3878-3881 [PMID:7966148] |
| ChEMBL | IC50 value against Prostaglandin G/H synthase 1 of human platelet rich plasma | B | 5.48 | pIC50 | 3300 | nM | IC50 | J Med Chem (1999) 42: 1161-1169 [PMID:10197960] |
| ChEMBL | IC50 against Prostaglandin G/H synthase 1 from human platelet rich plasma | B | 5.48 | pIC50 | 3300 | nM | IC50 | J Med Chem (1999) 42: 1151-1160 [PMID:10197959] |
| ChEMBL | The compound was evaluated for its inhibitory activity against Prostaglandin G/H synthase 1 using monocytes-like cells | B | 5.52 | pIC50 | 3000 | nM | IC50 | Bioorg Med Chem Lett (2002) 12: 779-782 [PMID:11859001] |
| Cyclooxygenase-1 in Bovine (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL2860] [UniProtKB: O62664] | ||||||||
| ChEMBL | Inhibition of bovine seminal microsomal COX1 assessed as PGE2 production preincubated for 10 mins | B | 4 | pIC50 | >100000 | nM | IC50 | J Nat Prod (1998) 61: 2-7 [PMID:9461646] |
| Cyclooxygenase-1 in Sheep (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL2949] [UniProtKB: P05979] | ||||||||
| ChEMBL | Inhibition of the ovine Prostaglandin G/H synthase 1 was determined by thin-layer chromatography assay | B | 4.18 | pIC50 | >66000 | nM | IC50 | Bioorg Med Chem Lett (2002) 12: 521-524 [PMID:11844663] |
| ChEMBL | In vitro inhibitory activity against Prostaglandin G/H synthase 1 in sheep | B | 4.43 | pIC50 | 37000 | nM | IC50 | Bioorg Med Chem Lett (1999) 9: 307-312 [PMID:10091674] |
| ChEMBL | IC50 against ovine Prostaglandin G/H synthase 1 | B | 4.7 | pIC50 | >20000 | nM | IC50 | J Med Chem (1999) 42: 1151-1160 [PMID:10197959] |
| ChEMBL | IC50 value against ovine Prostaglandin G/H synthase 1 | B | 4.7 | pIC50 | >20000 | nM | IC50 | J Med Chem (1999) 42: 1161-1169 [PMID:10197960] |
| ChEMBL | Inhibition of sheep COX1 by spectrophotometry | B | 4.85 | pIC50 | 14100 | nM | IC50 | J Med Chem (2010) 53: 6560-6571 [PMID:20804197] |
| COX-1 /Cyclooxygenase-1 in Mouse (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL2649] [GtoPdb: 1375] [UniProtKB: P22437] | ||||||||
| ChEMBL | Inhibition of COX1 in mouse RAW264.7 cells by enzyme immunoassay | B | 4.2 | pIC50 | 63700 | nM | IC50 | Bioorg Med Chem (2010) 18: 597-604 [PMID:20056549] |
| ChEMBL | Inhibitory activity against murine prostaglandin G/H synthase 1. | B | 5.78 | pIC50 | 1670 | nM | IC50 | Bioorg Med Chem Lett (2004) 14: 2559-2562 [PMID:15109651] |
| COX-2 /Cyclooxygenase-2 in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL230] [GtoPdb: 1376] [UniProtKB: P35354] | ||||||||
| ChEMBL | Inhibition of COX2-catalyzed prostaglandin biosynthesis after 10 mins of preincubation | B | 4.28 | pIC50 | 53000 | nM | IC50 | J Nat Prod (1998) 61: 1212-1215 [PMID:9784154] |
| ChEMBL | Inhibition of human cyclooxygenase 2 | B | 4.55 | pIC50 | 28000 | nM | IC50 | J Med Chem (2008) 51: 4150-4169 [PMID:18588282] |
| ChEMBL | Inhibitory concentration required against COX-2 activity in intact human monocytes | B | 5.49 | pIC50 | 3200 | nM | IC50 | Bioorg Med Chem Lett (1998) 8: 1169-1174 [PMID:9871729] |
| ChEMBL | Inhibition of human recombinant COX-2 using PGH2 as substrate incubated for 10 mins prior to arachidonic acid addition measured after 2 mins by EIA | B | 5.66 | pIC50 | 2200 | nM | IC50 | Bioorg Med Chem (2015) 23: 2518-2528 [PMID:25868745] |
| ChEMBL | Inhibition of recombinant human COX2 assessed as decrease in PGE2 release after 10 mins by ELISA | B | 5.68 | pIC50 | 2100 | nM | IC50 | Eur J Med Chem (2019) 162: 435-447 [PMID:30469039] |
| ChEMBL | Inhibition of human recombinant COX2 assessed as prostaglandin F2alpha level | B | 5.68 | pIC50 | 2100 | nM | IC50 | Eur J Med Chem (2014) 77: 155-165 [PMID:24631895] |
| ChEMBL | Inhibition of recombinant human COX2 by enzyme immunoassay | B | 5.74 | pIC50 | 1800 | nM | IC50 | Bioorg Med Chem Lett (2016) 26: 5193-5197 [PMID:27720548] |
| ChEMBL | Inhibition of human recombinant COX-2 assessed as decrease in PGH2 production using arachidonic acid as substrate treated with enzyme for 10 mins prior to substrate challenge for 2 mins by enzyme immunoassay | B | 5.74 | pIC50 | 1800 | nM | IC50 | Bioorg Med Chem Lett (2014) 24: 1958-1962 [PMID:24656662] |
| ChEMBL | Inhibition of human recombinant COX2 in cell-free system by enzyme immunoassay | B | 5.74 | pIC50 | 1800 | nM | IC50 | Bioorg Med Chem Lett (2014) 24: 5418-5422 [PMID:25453800] |
| ChEMBL | Inhibition of human recombinant COX2 assessed as inhibition of PGF2alpha production from PGH2 by enzyme immunoassay | B | 6 | pIC50 | 1000 | nM | IC50 | Eur J Med Chem (2012) 57: 59-64 [PMID:23047224] |
| ChEMBL | Inhibition of COX2 in human whole blood assessed as effect on LPS-stimulated PGE2 production | B | 6.21 | pIC50 | 610 | nM | IC50 | Bioorg Med Chem (2008) 16: 2697-2706 [PMID:18063374] |
| ChEMBL | Inhibition of COX2 (unknown origin) using arachidonic acid as substrate preincubated for 20 mins followed by substrate addition measured at 1 sec interval up to 60 secs by chemiluminescence assay | B | 6.59 | pIC50 | 260 | nM | IC50 | Eur J Med Chem (2019) 162: 435-447 [PMID:30469039] |
| ChEMBL | IC50 against recombinant human Prostaglandin G/H synthase 2 | B | 6.72 | pIC50 | 190 | nM | IC50 | J Med Chem (1999) 42: 1151-1160 [PMID:10197959] |
| ChEMBL | Inhibition of recombinant human prostaglandin G/H synthase 2 (COX-2) | B | 6.72 | pIC50 | 190 | nM | IC50 | J Med Chem (1999) 42: 1161-1169 [PMID:10197960] |
| ChEMBL | Inhibition of COX2 by scintillation proximity assay | B | 6.8 | pIC50 | 160 | nM | IC50 | J Nat Prod (2002) 65: 1517-1521 [PMID:12444669] |
| ChEMBL | Inhibition of COX2 | B | 6.8 | pIC50 | 160 | nM | IC50 | J Nat Prod (2005) 68: 985-991 [PMID:16038536] |
| ChEMBL | Inhibition of COX2 by microplate reader | B | 6.82 | pIC50 | 150 | nM | IC50 | J Nat Prod (2010) 73: 1234-1239 [PMID:20540535] |
| ChEMBL | Inhibition of the human Prostaglandin G/H synthase 2 was determined by thin-layer chromatography assay | B | 6.92 | pIC50 | 120 | nM | IC50 | Bioorg Med Chem Lett (2002) 12: 521-524 [PMID:11844663] |
| ChEMBL | In vitro inhibition of prostaglandin G/H synthase 2 (COX-2). | B | 7 | pIC50 | 100 | nM | IC50 | J Med Chem (1995) 38: 4570-4578 [PMID:7473585] |
| ChEMBL | In vitro inhibitory activity against inducible form of human recombinant cyclooxygenase (COX-2) | B | 7 | pIC50 | 100 | nM | IC50 | Bioorg Med Chem Lett (1995) 5: 867-872 |
| ChEMBL | In vitro inhibitory activity against Prostaglandin G/H synthase 2 (COX-2) in human | B | 7.05 | pIC50 | 90 | nM | IC50 | Bioorg Med Chem Lett (1999) 9: 307-312 [PMID:10091674] |
| ChEMBL | Tested for inhibition against Prostaglandin G/H synthase 2 | B | 8 | pIC50 | 10 | nM | IC50 | J Med Chem (1994) 37: 3878-3881 [PMID:7966148] |
| GtoPdb | Measuring inhibition of PGE2 production in human IL-1-stimulated synovial cells | - | 8.72 | pIC50 | 1.9 | nM | IC50 | J Med Chem (2000) 43: 2040-8 [PMID:10821716] |
| ChEMBL | The compound was evaluated for its inhibitory activity against Prostaglandin G/H synthase 2 using osteosarcomes cells | B | 9 | pIC50 | 1 | nM | IC50 | Bioorg Med Chem Lett (2002) 12: 779-782 [PMID:11859001] |
| Cyclooxygenase-2 in Sheep (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL4102] [UniProtKB: P79208] | ||||||||
| ChEMBL | Inhibition of sheep COX2 by spectrophotometry | B | 4.14 | pIC50 | 73200 | nM | IC50 | J Med Chem (2010) 53: 6560-6571 [PMID:20804197] |
| ChEMBL | Inhibition of sheep placental cotyledons COX2 assessed as PGE2 production preincubated for 10 mins | B | 4.28 | pIC50 | 53000 | nM | IC50 | J Nat Prod (1998) 61: 2-7 [PMID:9461646] |
| ChEMBL | Inhibition of COX2 in sheep placental vesicle by enzyme immunoassay | B | 5.59 | pIC50 | 2600 | nM | IC50 | Bioorg Med Chem (2009) 17: 4459-4465 [PMID:19481465] |
| ChEMBL | Inhibition of sheep placental cotyledens COX2 assessed as PGE2 level by EIA | B | 5.59 | pIC50 | 2600 | nM | IC50 | Bioorg Med Chem (2010) 18: 2809-2815 [PMID:20236826] |
| ChEMBL | Inhibition of sheep placental COX2 assessed as PGE2 production by enzyme immunoassay | B | 5.68 | pIC50 | 2100 | nM | IC50 | J Nat Prod (2011) 74: 1779-1786 [PMID:21800856] |
| COX-2 /Cyclooxygenase-2 in Mouse (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL4321] [GtoPdb: 1376] [UniProtKB: Q05769] | ||||||||
| ChEMBL | Inhibition of COX2 in mouse RAW264.7 cells by enzyme immunoassay | B | 6.09 | pIC50 | 810 | nM | IC50 | Bioorg Med Chem (2010) 18: 597-604 [PMID:20056549] |
| ChEMBL | Inhibition of COX2-mediated PGE2 production in LPS-stimulated mouse RAW264.7 cells by enzyme immunoassay | B | 7.3 | pIC50 | 50 | nM | IC50 | Bioorg Med Chem Lett (2009) 19: 1650-1653 [PMID:19233646] |
| ChEMBL | IC50 value was determined against Prostaglandin G/H synthase 2 of J7744A.1 cell lines. | B | 7.66 | pIC50 | 22 | nM | IC50 | J Med Chem (1999) 42: 1151-1160 [PMID:10197959] |
| ChEMBL | IC50 value against Prostaglandin G/H synthase 2 of murine J774A.1 cell line | B | 7.66 | pIC50 | 22 | nM | IC50 | J Med Chem (1999) 42: 1161-1169 [PMID:10197960] |
| ChEMBL | Inhibition of COX-2 in mouse RAW264.7 cells assessed as decrease in LPS-induced PGE2 production treated prior to LPS challenge by enzyme immunoassay | B | 8.15 | pIC50 | 7 | nM | IC50 | Bioorg Med Chem Lett (2014) 24: 1958-1962 [PMID:24656662] |
| ChEMBL | Inhibitory activity against murine Prostaglandin G/H synthase 2. | B | 8.7 | pIC50 | <2 | nM | IC50 | Bioorg Med Chem Lett (2004) 14: 2559-2562 [PMID:15109651] |
| CYP19A1/Cytochrome P450 19A1 in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL1978] [GtoPdb: 1362] [UniProtKB: P11511] | ||||||||
| ChEMBL | Inhibition of CYP450 aromatase activity in SK-BR-3 cells | B | 6.17 | pIC50 | 680 | nM | IC50 | J Med Chem (2006) 49: 1413-1419 [PMID:16480277] |
| ChEMBL | Inhibition of aromatase in human SKBR3 cells by tritiated water release assay | B | 6.17 | pIC50 | 680 | nM | IC50 | J Med Chem (2008) 51: 1126-1135 [PMID:18271519] |
| mPGES1/Prostaglandin E synthase in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL5658] [GtoPdb: 1377] [UniProtKB: O14684] | ||||||||
| ChEMBL | Inhibition of microsomal PGES | B | 4.7 | pIC50 | 20000 | nM | IC50 | Bioorg Med Chem (2011) 19: 6077-6086 [PMID:21920764] |
| ChEMBL | Inhibition of mPGES-1 in human A549 cell microsomes assessed as conversion of PGH2 into PGE2 at 0 degC after 5 mins by HPLC-UV analysis | B | 4.7 | pIC50 | 20000 | nM | IC50 | Eur J Med Chem (2012) 48: 153-163 [PMID:22209272] |
| ChEMBL | Inhibition of microsomal PGES1 using PGH2 as substrate by RP-HPLC method | B | 4.7 | pIC50 | 20000 | nM | IC50 | Bioorg Med Chem Lett (2012) 22: 7335-7339 [PMID:23147075] |
| ChEMBL | Inhibition of mPGES-1 | B | 5 | pIC50 | 10000 | nM | IC50 | Eur J Med Chem (2012) 48: 153-163 [PMID:22209272] |
| mPGES1/Prostaglandin E synthase in Mouse (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL2046261] [GtoPdb: 1377] [UniProtKB: Q9JM51] | ||||||||
| ChEMBL | Inhibition of mPGES-1 in mouse RAW264.7 cells assessed as reduction in LPS-induced PGE2 production after 24 hrs | B | 8.15 | pIC50 | 7 | nM | IC50 | Bioorg Med Chem Lett (2016) 26: 5193-5197 [PMID:27720548] |
ChEMBL data shown on this page come from version 34:
Zdrazil B, Felix E, Hunter F, Manners EJ, Blackshaw J, Corbett S, de Veij M, Ioannidis H, Lopez DM, Mosquera JF, Magarinos MP, Bosc N, Arcila R, Kizilören T, Gaulton A, Bento AP, Adasme MF, Monecke P, Landrum GA, Leach AR. (2024). The ChEMBL Database in 2023: a drug discovery platform spanning multiple bioactivity data types and time periods. Nucleic Acids Res., 52(D1). DOI: 10.1093/nar/gkad1004. [EPMCID:10767899] [PMID:37933841]
Davies M, Nowotka M, Papadatos G, Dedman N, Gaulton A, Atkinson F, Bellis L, Overington JP. (2015) 'ChEMBL web services: streamlining access to drug discovery data and utilities.' Nucleic Acids Res., 43(W1). DOI: 10.1093/nar/gkv352. [EPMCID:25883136]
