β-phenylethylamine [Ligand Id: 2144] activity data from GtoPdb and ChEMBL
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| ChEMBL ligand: CHEMBL610 (Phenethylamine, Phenylethylamine) |
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| DB | Assay description | Assay Type | Standard value | Standard parameter | Original value | Original units | Original parameter | Reference |
|---|---|---|---|---|---|---|---|---|
| lysyl oxidase like 2/Lysyl oxidase homolog 2 in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL3714029] [GtoPdb: 2853] [UniProtKB: Q9Y4K0] | ||||||||
| ChEMBL | Inhibition of full length recombinant human LOXL2 expressed in CHO cells assessed as reduction in H2O2 production using DAP as substrate preincubated for 2 hrs followed by substrate addition measured every 2 minutes for 50 minutes by Amplex red dye based fluorescence assay | B | 4.22 | pIC50 | 60100 | nM | IC50 | ACS Med Chem Lett (2017) 8: 423-427 [PMID:28435530] |
| 5-HT2A receptor/Serotonin 2a (5-HT2a) receptor in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL224] [GtoPdb: 6] [UniProtKB: P28223] | ||||||||
| ChEMBL | Binding affinity was performed using [3H]ketanserin as the radioligand and stably transfected NIH3T3 cells expressing the 5-hydroxytryptamine 2A receptor (GF-62 cells). | B | 4.77 | pKi | 16800 | nM | Ki | J Med Chem (2002) 45: 1656-1664 [PMID:11931619] |
| ChEMBL | Displacement of [3H]ketanserin from 5HT2A receptor expressed in NIH3T3 cells | B | 4.77 | pKi | 16800 | nM | Ki | J Med Chem (2008) 51: 6808-6828 [PMID:18847250] |
| 5-HT2A receptor/Serotonin 2a (5-HT2a) receptor in Rat (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL322] [GtoPdb: 6] [UniProtKB: P14842] | ||||||||
| ChEMBL | Binding affinity against 5-hydroxytryptamine 2A receptor expressed NIH3T3 cells using [3H]ketanserin | B | 4.77 | pKi | 16820 | nM | Ki | Bioorg Med Chem Lett (2001) 11: 563-566 [PMID:11229772] |
| ChEMBL | Displacement of [3H]ketanserin from rat 5HT2A expressed in mouse NIH/3T3 cell membranes after 30 mins by scintillation counting method | B | 5 | pKi | >10000 | nM | Ki | J Med Chem (2017) 60: 2605-2628 [PMID:28244748] |
| TA1 receptor/Trace amine-associated receptor 1 in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL5857] [GtoPdb: 364] [UniProtKB: Q96RJ0] | ||||||||
| ChEMBL | Agonist activity at human TAAR1 expressed in HEK293 cells assessed as cAMP accumulation after 20 mins by BRET assay | F | 6.89 | pEC50 | 130 | nM | EC50 | Eur J Med Chem (2018) 146: 171-184 [PMID:29407948] |
| ChEMBL | Agonist activity at human trace amine associated receptor 1 expressed in RD-HGA16 CHO-K1 cells coexpressed with Galpha16 protein assessed as internal calcium mobilization by calcium 3 assay | F | 6.89 | pEC50 | 129 | nM | EC50 | Bioorg Med Chem (2008) 16: 7415-7423 [PMID:18602830] |
| ChEMBL | Agonist activity at human TAAR1 receptor expressed in HEK293T cells cotransfected with beta-2 receptor assessed as cAMP production by BRET assay | F | 6.96 | pEC50 | 110 | nM | EC50 | Medchemcomm (2015) 6: 2216-2223 |
| ChEMBL | Activation of human TAAR1 expressed in Syrian hamster AV12-664 cells co-expressing GalphaS protein assessed as accumulation of cAMP after 30 mins using cAMP XS EA/CL as substrate by luminescence method in presence of RX821002 and alprenolol | F | 6.97 | pEC50 | 106 | nM | EC50 | Bioorg Med Chem (2011) 19: 7044-7048 [PMID:22037049] |
| GtoPdb | - | - | 7 | pEC50 | - | - | - |
Proc Natl Acad Sci USA (2001) 98: 8966-71 [PMID:11459929]; Mol Pharmacol (2008) 74: 585-594 [PMID:18524885]; J Pharmacol Exp Ther (2007) 320: 475-85 [PMID:17038507]; Bioorg Med Chem (2008) 16: 7415-23 [PMID:18602830]; Biochem J (2009) 424: 39-45 [PMID:19725810]; PLoS ONE (2011) 6: e27073 [PMID:22073124] |
| ChEMBL | Agonist activity at recombinant human TAAR1 expressed in CHO-K1 cells assessed as increase in intracellular cAMP incubated for 30 mins by HTRF analysis | F | 7.82 | pEC50 | 15 | nM | EC50 | ACS Med Chem Lett (2022) 13: 92-98 [PMID:35047111] |
| TA1 receptor/Trace amine-associated receptor 1 in Mouse (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL4908] [GtoPdb: 364] [UniProtKB: Q923Y8] | ||||||||
| ChEMBL | Activation of mouse wild type TAAR1 expressed in HEK293 cells assessed as stimulation of cAMP production after 1 hr by chemiluminescent assay | F | 6.72 | pEC50 | 189 | nM | EC50 | J Med Chem (2014) 57: 378-390 [PMID:24354319] |
| ChEMBL | Agonist activity at mouse TAAR1 expressed in HEK293 cells coexpressing cAMP BRET biosensor assessed as induction of CAMP production after 20 mins by bioluminescence resonance energy transfer assay | F | 6.86 | pEC50 | 138 | nM | EC50 | J Med Chem (2015) 58: 5096-5107 [PMID:26010728] |
| ChEMBL | Agonist activity at mouse TAAR1 expressed in HEK293T cells assessed as induction of cAMP production by BRET assay | F | 6.86 | pEC50 | 138 | nM | EC50 | J Med Chem (2016) 59: 9825-9836 [PMID:27731647] |
| ChEMBL | Agonist activity at mouse TAAR1 expressed in HEK293 cells assessed as cAMP accumulation after 20 mins by BRET assay | F | 6.92 | pEC50 | 120 | nM | EC50 | Eur J Med Chem (2018) 146: 171-184 [PMID:29407948] |
| ChEMBL | Activation of mouse TAAR1 transmembrane domain 7 Tyr287(7.39)Asn mutant expressed in HEK293 cells assessed as stimulation of cAMP production after 1 hr by chemiluminescent assay | F | 7.23 | pEC50 | 58.6 | nM | EC50 | J Med Chem (2014) 57: 378-390 [PMID:24354319] |
| ChEMBL | Activation of mouse TAAR1 transmembrane domain 6 Thr268(6.55)Met mutant expressed in HEK293 cells assessed as stimulation of cAMP production after 1 hr by chemiluminescent assay | F | 7.33 | pEC50 | 47.3 | nM | EC50 | J Med Chem (2014) 57: 378-390 [PMID:24354319] |
| GtoPdb | - | - | 7.4 | pEC50 | - | - | - |
J Pharmacol Exp Ther (2007) 321: 178-86 [PMID:17218486]; Genes Brain Behav (2007) 6: 628-39 [PMID:17212650]; Biochem J (2009) 424: 39-45 [PMID:19725810] |
| TA1 receptor/Trace amine-associated receptor 1 in Rat (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL3833] [GtoPdb: 364] [UniProtKB: Q923Y9] | ||||||||
| ChEMBL | Activation of rat TAAR1 transmembrane domain 6 Met268(6.55)Thr mutant expressed in HEK293 cells assessed as stimulation of cAMP production after 1 hr by chemiluminescent assay | F | 6.58 | pEC50 | 261.2 | nM | EC50 | J Med Chem (2014) 57: 378-390 [PMID:24354319] |
| GtoPdb | - | - | 6.6 | pEC50 | - | - | - |
J Pharmacol Exp Ther (2007) 321: 178-86 [PMID:17218486]; Mol Pharmacol (2001) 60: 1181-8 [PMID:11723224] |
| ChEMBL | Agonist activity at rat N-terminal FLAG-tagged TAAR1 expressed in HEK293 cells assessed as [3H]cAMP accumulation measured after 1 hr | F | 6.62 | pEC50 | 240 | nM | EC50 | J Med Chem (2017) 60: 2605-2628 [PMID:28244748] |
| ChEMBL | Activation of rat TAAR1 expressed in Syrian hamster AV12-664 cells assessed as accumulation of cAMP after 30 mins using cAMP XS EA/CL as substrate by luminescence method | F | 6.68 | pEC50 | 209 | nM | EC50 | Bioorg Med Chem (2011) 19: 7044-7048 [PMID:22037049] |
| ChEMBL | Activation of rat TAAR1 transmembrane domain 7 Asn287(7.39)Tyr mutant expressed in HEK293 cells assessed as stimulation of cAMP production after 1 hr by chemiluminescent assay | F | 6.77 | pEC50 | 170.6 | nM | EC50 | J Med Chem (2014) 57: 378-390 [PMID:24354319] |
| ChEMBL | Activation of rat wild type TAAR1 expressed in HEK293 cells assessed as stimulation of cAMP production after 1 hr by chemiluminescent assay | F | 7.39 | pEC50 | 40.33 | nM | EC50 | J Med Chem (2014) 57: 378-390 [PMID:24354319] |
| serine protease 1/Trypsin I in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL209] [GtoPdb: 2397] [UniProtKB: P07477] | ||||||||
| ChEMBL | Binding affinity against trypsin | B | 1.96 | pKd | -1.96 | - | Log Kd | J Med Chem (2002) 45: 2770-2780 [PMID:12061879] |
| Trypsin I in Bovine (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL3769] [UniProtKB: P00760] | ||||||||
| ChEMBL | Binding affinity against bovine trypsin | B | 4.96 | pKi | 11000 | nM | Ki | J Med Chem (2002) 45: 2469-2483 [PMID:12036355] |
| TAAR4P in Mouse [GtoPdb: 169] [UniProtKB: Q5QD15] | ||||||||
| GtoPdb | - | - | 6 | pEC50 | 1000 | nM | EC50 | Nature (2006) 442: 645-650 [PMID:16878137] |
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]
