bergapten [Ligand Id: 12431] activity data from GtoPdb and ChEMBL
Click here for a description of the charts and data table
Please tell us if you are using this feature and what you think!
| ChEMBL ligand: CHEMBL24171 (5-methoxypsoralen, Bergaptan, Bergapten, Bergaptene, Geralen, Heraclin, Majudin, Methoxsalen related compound a, NSC-95437) |
|---|
There should be some charts here, you may need to enable JavaScript!
|
There should be some charts here, you may need to enable JavaScript!
|
There should be some charts here, you may need to enable JavaScript!
|
|
There should be some charts here, you may need to enable JavaScript!
|
| DB | Assay description | Assay Type | Standard value | Standard parameter | Original value | Original units | Original parameter | Reference |
|---|---|---|---|---|---|---|---|---|
| CYP1A1/Cytochrome P450 1A1 in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL2231] [GtoPdb: 1318] [UniProtKB: P04798] | ||||||||
| ChEMBL | Inhibition of human recombinant CYP1A1 expressed in HEK293 cells using 7-ethoxyresorufin substrate preincubated for 30 mins followed by substrate addition and measured after 60 mins by fluorescence assay relative to control | B | 7.22 | pKi | 60 | nM | Ki | Medchemcomm (2018) 9: 371-382 [PMID:30108931] |
| ChEMBL | Inhibition of human recombinant CYP1A1 expressed in HEK293 cells using 7-ethoxyresorufin substrate preincubated for 30 mins followed by substrate addition and measured after 60 mins by fluorescence assay relative to control | B | 7.1 | pIC50 | 80 | nM | IC50 | Medchemcomm (2018) 9: 371-382 [PMID:30108931] |
| Monoamine oxidase A in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL1951] [GtoPdb: 2489] [UniProtKB: P21397] | ||||||||
| ChEMBL | Inhibition of MAO-A (unknown origin) | B | 4.86 | pIC50 | 13800 | nM | IC50 | Bioorg Med Chem (2013) 21: 2434-2450 [PMID:23517722] |
| Kv1.2/Voltage-gated potassium channel subunit Kv1.2 in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL2086] [GtoPdb: 539] [UniProtKB: P16389] | ||||||||
| ChEMBL | Blockade of peak K+ currents against Kv1.2 gene | F | 4.39 | pKd | 41000 | nM | Kd | J Med Chem (1998) 41: 4542-4549 [PMID:9804693] |
| TAS2R10 in Human [GtoPdb: 666] [UniProtKB: Q9NYW0] | ||||||||
| GtoPdb | - | - | 5.55 | pEC50 | 2800 | nM | EC50 | Molecules (2015) 20: 18907-22 [PMID:26501253] |
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]
