SB 206553 [Ligand Id: 189] activity data from GtoPdb and ChEMBL
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| ChEMBL ligand: CHEMBL297784 (SB-206553) |
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| DB | Assay description | Assay Type | Standard value | Standard parameter | Original value | Original units | Original parameter | Reference |
|---|---|---|---|---|---|---|---|---|
| A1 receptor/Adenosine A1 receptor in Rat (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL318] [GtoPdb: 18] [UniProtKB: P25099] | ||||||||
| ChEMBL | Binding affinity against rat Adenosine A1 receptor | B | 4.3 | pKi | <50118.72 | nM | Ki | J Med Chem (1995) 38: 2524-2530 [PMID:7629791] |
| CYP19A1/Cytochrome P450 19A1 in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL1978] [GtoPdb: 1362] [UniProtKB: P11511] | ||||||||
| ChEMBL | Inhibition of heterologously expressed human Cytochrome P450 19A1 at 100 uM | B | 4 | pIC50 | >100000 | nM | IC50 | J Med Chem (1997) 40: 3494-3496 [PMID:9357513] |
| D2 receptor/Dopamine D2 receptor in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL217] [GtoPdb: 215] [UniProtKB: P14416] | ||||||||
| ChEMBL | Binding affinity against human Dopamine receptor D2 expressed in CHO cells using [125I]iodosulpiride | B | 5 | pKi | <10000 | nM | Ki | J Med Chem (1995) 38: 2524-2530 [PMID:7629791] |
| D3 receptor/Dopamine D3 receptor in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL234] [GtoPdb: 216] [UniProtKB: P35462] | ||||||||
| ChEMBL | Binding affinity human Dopamine receptor D3 expressed in CHO cells using [125I]iodosulpiride | B | 5 | pKi | <10000 | nM | Ki | J Med Chem (1995) 38: 2524-2530 [PMID:7629791] |
| Histamine H1 receptor in Guinea pig (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL3943] [UniProtKB: P31389] | ||||||||
| ChEMBL | Binding affinity against guinea pig H1 receptor | B | 5 | pKi | <10000 | nM | Ki | J Med Chem (1995) 38: 2524-2530 [PMID:7629791] |
| histone deacetylase 6/Histone deacetylase 6 in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL1865] [GtoPdb: 2618] [UniProtKB: Q9UBN7] | ||||||||
| ChEMBL | Determination of IC50 values for inhibition of enzymatic assay of human HDAC6 with custom peptide substrate | B | 6.37 | pIC50 | 426.7 | nM | IC50 | HDAC6 screening dataset using tau-based substrate in an enzymatic assay yields selective inhibitors and activators |
| nicotinic acetylcholine receptor α7 subunit/Neuronal acetylcholine receptor protein alpha-7 subunit in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL2492] [GtoPdb: 468] [UniProtKB: P36544] | ||||||||
| ChEMBL | Agonist activity at human alpha7 nAChR expressed in GH4C1 cells assessed as potentiation of nicotine-induced calcium signal | F | 5.82 | pEC50 | 1500 | nM | EC50 | J Med Chem (2011) 54: 7943-7961 [PMID:21919481] |
| 5-HT1A receptor/Serotonin 1a (5-HT1a) receptor in Rat (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL273] [GtoPdb: 1] [UniProtKB: P19327] | ||||||||
| ChEMBL | Binding affinity against rat 5-hydroxytryptamine 1A receptor | B | 5 | pKi | <10000 | nM | Ki | J Med Chem (1995) 38: 2524-2530 [PMID:7629791] |
| Serotonin 1d (5-HT1d) receptor in Guinea pig (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL2304407] [UniProtKB: Q60484] | ||||||||
| ChEMBL | Binding affinity against guinea pig 5-hydroxytryptamine 1D receptor | B | 6 | pKi | <1000 | nM | Ki | J Med Chem (1995) 38: 2524-2530 [PMID:7629791] |
| 5-ht1e receptor/Serotonin 1e (5-HT1e) receptor in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL2182] [GtoPdb: 4] [UniProtKB: P28566] | ||||||||
| ChEMBL | Binding affinity against human 5-hydroxytryptamine 1E receptor expressed in CHO cells | B | 5.3 | pKi | <5011.87 | nM | Ki | J Med Chem (1995) 38: 2524-2530 [PMID:7629791] |
| 5-HT2A receptor/Serotonin 2a (5-HT2a) receptor in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL224] [GtoPdb: 6] [UniProtKB: P28223] | ||||||||
| ChEMBL | Displacement of [3H]ketanserin from 5-hydroxytryptamine 2A receptor expressed in HEK 293 cells | B | 5.7 | pKi | 1995.26 | nM | Ki | J Med Chem (1997) 40: 3494-3496 [PMID:9357513] |
| ChEMBL | Binding affinity towards human 5-hydroxytryptamine 2A receptor expressed in HEK 293 cells using [3H]ketanserin as radioligand | B | 5.7 | pKi | 1995.26 | nM | Ki | J Med Chem (1998) 41: 1598-1612 [PMID:9572885] |
| ChEMBL | Binding affinity against human 5-hydroxytryptamine 2A receptor expressed in 293 cells using [3H]ketanserin | B | 5.79 | pKi | 1621.81 | nM | Ki | J Med Chem (1995) 38: 2524-2530 [PMID:7629791] |
| ChEMBL | Binding affinity analysed on 5-HT 2A human clone using [3H]ketanserin as radioligand | B | 5.79 | pKi | 1621.81 | nM | Ki | J Med Chem (1996) 39: 2773-2780 [PMID:8709108] |
| GtoPdb | - | - | 5.8 | pKi | - | - | - |
Naunyn Schmiedebergs Arch Pharmacol (2004) 370: 114-23 [PMID:15322733]; Br J Pharmacol (1996) 117: 427-434 [PMID:8821530] |
| 5-HT2A receptor/Serotonin 2a (5-HT2a) receptor in Rat (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL322] [GtoPdb: 6] [UniProtKB: P14842] | ||||||||
| ChEMBL | Displacement of [3H]ketanserin from 5-HT2A receptor of rat frontal cortex | B | 6.3 | pKi | 501.19 | nM | Ki | J Med Chem (1996) 39: 4966-4977 [PMID:8960557] |
| 5-HT2B receptor/Serotonin 2b (5-HT2b) receptor in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL1833] [GtoPdb: 7] [UniProtKB: P41595] | ||||||||
| ChEMBL | Binding affinity towards cloned human 5-hydroxytryptamine 2B receptor expressed in HEK 293 cells using [3H]5-HT as radioligand | B | 7.6 | pKi | 25.12 | nM | Ki | J Med Chem (1998) 41: 1598-1612 [PMID:9572885] |
| ChEMBL | Displacement of [3H]5-HT from 5-hydroxytryptamine 2B receptor expressed in HEK 293 cells | B | 7.6 | pKi | 25.12 | nM | Ki | J Med Chem (1997) 40: 3494-3496 [PMID:9357513] |
| ChEMBL | Displacement of [3H]LSD from human 5HT2B receptor expressed in HEK cells membranes after 1.5 hrs by liquid scintillation counting method | B | 7.65 | pKi | 22.2 | nM | Ki | Medchemcomm (2018) 9: 1069-1075 [PMID:30108996] |
| ChEMBL | Displacement of [3H]LSD from human recombinant 5-HT2B receptor stably expressed in HEK cell membrane after 90 mins by scintillation counting method | B | 7.68 | pKi | 21 | nM | Ki | Medchemcomm (2015) 6: 601-605 |
| ChEMBL | Displacement of [3H]LSD from 5-HT2B receptor (unknown origin) assessed as inhibition constant incubated for 90 mins by MicroBeta scintillation counting method | B | 7.7 | pKi | 20 | nM | Ki | J Nat Prod (2022) 85: 2149-2158 [PMID:36001775] |
| ChEMBL | Displacement of [3H]LSD from 5-HT2B receptor (unknown origin) | B | 7.92 | pKi | 12.02 | nM | Ki | Bioorg Med Chem Lett (2014) 24: 576-579 [PMID:24365159] |
| ChEMBL | Displacement of [3H]LSD from 5-HT2B receptor (unknown origin) | B | 7.92 | pKi | 12 | nM | Ki | Bioorg Med Chem Lett (2014) 24: 576-579 [PMID:24365159] |
| ChEMBL | Displacement of [3H]LSD from human cloned 5HT2B receptor expressed in CHO cells by liquid scintillation counting | B | 8.37 | pKi | 4.3 | nM | Ki | J Med Chem (2010) 53: 7573-7586 [PMID:20958049] |
| GtoPdb | - | - | 8.5 | pKi | - | - | - |
Naunyn Schmiedebergs Arch Pharmacol (2004) 370: 114-23 [PMID:15322733]; Br J Pharmacol (2004) 143: 549-60 [PMID:15466450] |
| ChEMBL | Antagonist activity at recombinant human 5-HT2B receptor expressed in CHOK1 cells assessed as inhibition of serotonin-induced increase in inositol1-phosphate accumulation measured after 30 mins by HTRF assay | F | 7.89 | pEC50 | 13 | nM | EC50 | J Med Chem (2020) 63: 5526-5567 [PMID:32342685] |
| 5-HT2B receptor/Serotonin 2b (5-HT2b) receptor in Rat (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL323] [GtoPdb: 7] [UniProtKB: P30994] | ||||||||
| ChEMBL | Inhibitory potency against rat stomach fundus 5-hydroxytryptamine 2B receptor | B | 8.48 | pKd | 3.31 | nM | Kd | J Med Chem (1995) 38: 2524-2530 [PMID:7629791] |
| ChEMBL | Inhibition of 5-HT binding to 5-HT2B receptor of Rat stomach fundus | B | 8.5 | pKd | 3.16 | nM | Kd | J Med Chem (1996) 39: 4966-4977 [PMID:8960557] |
| 5-HT2C receptor/Serotonin 2c (5-HT2c) receptor in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL225] [GtoPdb: 8] [UniProtKB: P28335] | ||||||||
| ChEMBL | Displacement of [3H]mesulergine from 5-hydroxytryptamine 2C receptor expressed in HEK 293 cells | B | 7.9 | pKi | 12.59 | nM | Ki | J Med Chem (1997) 40: 3494-3496 [PMID:9357513] |
| ChEMBL | Binding affinity towards cloned human 5-hydroxytryptamine 2C receptor expressed in HEK 293 cells using [3H]mesulergine as radioligand | B | 7.9 | pKi | 12.59 | nM | Ki | J Med Chem (1998) 41: 1598-1612 [PMID:9572885] |
| GtoPdb | - | - | 7.9 | pKi | - | - | - |
Naunyn Schmiedebergs Arch Pharmacol (2004) 370: 114-23 [PMID:15322733]; Br J Pharmacol (1996) 117: 427-434 [PMID:8821530] |
| ChEMBL | Binding affinity against human 5-hydroxytryptamine 2C receptor expressed in 293 cells using [3H]mesulergine | B | 8 | pKi | 10 | nM | Ki | J Med Chem (1995) 38: 2524-2530 [PMID:7629791] |
| ChEMBL | Displacement of [3H]LSD from human recombinant 5-HT2C receptor expressed in HEK cells by radioligand completion assay relative to control | B | 8.55 | pKi | 2.8 | nM | Ki | J Med Chem (2021) 64: 13510-13523 [PMID:34467758] |
| ChEMBL | Antagonist activity at human recombinant 5-HT2C receptor assessed as inhibition of serotonin-induced inositol phosphate accumulation | F | 8.03 | pIC50 | 9.4 | nM | IC50 | J Med Chem (2014) 57: 4543-4557 [PMID:24805037] |
| 5-HT2C receptor/Serotonin 2c (5-HT2c) receptor in Mouse (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL3006] [GtoPdb: 8] [UniProtKB: P34968] | ||||||||
| ChEMBL | Binding affinity analysed on 5-HT 2C in human clone using [3H]mesulergine as radioligand | B | 8 | pKi | 10 | nM | Ki | J Med Chem (1996) 39: 2773-2780 [PMID:8709108] |
| 5-HT2C receptor/Serotonin 2c (5-HT2c) receptor in Rat (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL324] [GtoPdb: 8] [UniProtKB: P08909] | ||||||||
| ChEMBL | Displacement of [3H]mesulergine from rat 5-HT2C receptor expressed in HEK293 | B | 8.3 | pKi | 5.01 | nM | Ki | J Med Chem (1996) 39: 4966-4977 [PMID:8960557] |
| 5-HT3A/5-HT3B/Serotonin 3 (5-HT3) receptor in Rat (target type: PROTEIN COMPLEX) [ChEMBL: CHEMBL2094116] [GtoPdb: 373, 374] [UniProtKB: P35563, Q9JJ16] | ||||||||
| ChEMBL | Binding affinity against rat 5-hydroxytryptamine 3 receptor | B | 5 | pKi | <10000 | nM | Ki | J Med Chem (1995) 38: 2524-2530 [PMID:7629791] |
| 5-HT4 receptor/Serotonin 4 (5-HT4) receptor in Rat (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL4317] [GtoPdb: 9] [UniProtKB: Q62758] | ||||||||
| ChEMBL | Binding affinity against rat 5-hydroxytryptamine 4 receptor | B | 5.3 | pKi | 5011.87 | nM | Ki | J Med Chem (1995) 38: 2524-2530 [PMID:7629791] |
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]
