compound 1a [PMID: 18573659] [Ligand Id: 8872] activity data from GtoPdb and ChEMBL
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| ChEMBL ligand: CHEMBL495075 |
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| DB | Assay description | Assay Type | Standard value | Standard parameter | Original value | Original units | Original parameter | Reference |
|---|---|---|---|---|---|---|---|---|
| 5-HT1A receptor/5-hydroxytryptamine receptor 1A in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL214] [GtoPdb: 1] [UniProtKB: P08908] | ||||||||
| ChEMBL | Binding affinity to 5HT1A receptor | B | 7.42 | pKi | 38 | nM | Ki | Bioorg Med Chem Lett (2008) 18: 3950-3954 [PMID:18573659] |
| 5-HT1D receptor/5-hydroxytryptamine receptor 1D in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL1983] [GtoPdb: 3] [UniProtKB: P28221] | ||||||||
| ChEMBL | Binding affinity to 5HT1D receptor | B | 6.85 | pKi | 140 | nM | Ki | Bioorg Med Chem Lett (2008) 18: 3950-3954 [PMID:18573659] |
| 5-ht1e receptor/5-hydroxytryptamine receptor 1E in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL2182] [GtoPdb: 4] [UniProtKB: P28566] | ||||||||
| ChEMBL | Binding affinity to 5HT1E receptor | B | 5 | pKi | >10000 | nM | Ki | Bioorg Med Chem Lett (2008) 18: 3950-3954 [PMID:18573659] |
| 5-HT1F receptor/5-hydroxytryptamine receptor 1F in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL1805] [GtoPdb: 5] [UniProtKB: P30939] | ||||||||
| ChEMBL | Binding affinity to 5HT1F receptor | B | 5.14 | pKi | 7200 | nM | Ki | Bioorg Med Chem Lett (2008) 18: 3950-3954 [PMID:18573659] |
| 5-HT2B receptor/5-hydroxytryptamine receptor 2B in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL1833] [GtoPdb: 7] [UniProtKB: P41595] | ||||||||
| ChEMBL | Binding affinity at 5HT2B receptor | B | 6.85 | pKi | 140 | nM | Ki | Bioorg Med Chem Lett (2008) 18: 3950-3954 [PMID:18573659] |
| 5-HT2C receptor/5-hydroxytryptamine receptor 2C in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL225] [GtoPdb: 8] [UniProtKB: P28335] | ||||||||
| ChEMBL | Binding affinity at 5HT2C receptor | B | 7.07 | pKi | 85 | nM | Ki | Bioorg Med Chem Lett (2008) 18: 3950-3954 [PMID:18573659] |
| 5-HT6 receptor/5-hydroxytryptamine receptor 6 in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL3371] [GtoPdb: 11] [UniProtKB: P50406] | ||||||||
| ChEMBL | Binding affinity to 5HT6 receptor | B | 5.39 | pKi | 4100 | nM | Ki | Bioorg Med Chem Lett (2008) 18: 3950-3954 [PMID:18573659] |
| β2-adrenoceptor/Beta-2 adrenergic receptor in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL210] [GtoPdb: 29] [UniProtKB: P07550] | ||||||||
| ChEMBL | Binding affinity to beta 2 adrenergic receptor | B | 5 | pKi | >10000 | nM | Ki | Bioorg Med Chem Lett (2008) 18: 3950-3954 [PMID:18573659] |
| D2 receptor/D(2) dopamine receptor in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL217] [GtoPdb: 215] [UniProtKB: P14416] | ||||||||
| ChEMBL | Binding affinity to dopamine D2 receptor | B | 7 | pKi | 100 | nM | Ki | Bioorg Med Chem Lett (2008) 18: 3950-3954 [PMID:18573659] |
| UT receptor/Urotensin-2 receptor in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL3764] [GtoPdb: 365] [UniProtKB: Q9UKP6] | ||||||||
| ChEMBL | Displacement of [I125]hU2 from human recombinant urotensin 2 receptor expressed in HEK293 cells | B | 8.4 | pKi | 4 | nM | Ki | Bioorg Med Chem Lett (2008) 18: 3950-3954 [PMID:18573659] |
| GtoPdb | Ligand binding. | - | 8.4 | pKi | 4 | nM | Ki | Bioorg Med Chem Lett (2008) 18: 3950-4 [PMID:18573659] |
| ChEMBL | Antagonist activity at human recombinant urotensin 2 receptor expressed in HEK293 cells assessed as inhibition of urotensin 2-induced calcium mobilization by FLIPR assay | F | 8.4 | pIC50 | 4 | nM | IC50 | Bioorg Med Chem Lett (2008) 18: 3950-3954 [PMID:18573659] |
| CYP3A4 in Human [GtoPdb: 1337] [UniProtKB: P08684] | ||||||||
| GtoPdb | - | - | 5.72 | pIC50 | 1900 | nM | IC50 | Bioorg Med Chem Lett (2008) 18: 3950-4 [PMID:18573659] |
ChEMBL data shown on this page come from version 36:
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]
