apalutamide [Ligand Id: 9043] activity data from GtoPdb and ChEMBL
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| ChEMBL ligand: CHEMBL3183409 (Apalutamide, Arn-509, ARN-509, Erleada, JNJ-56021927) |
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| DB | Assay description | Assay Type | Standard value | Standard parameter | Original value | Original units | Original parameter | Reference |
|---|---|---|---|---|---|---|---|---|
| Androgen receptor/Androgen Receptor in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL1871] [GtoPdb: 628] [UniProtKB: P10275] | ||||||||
| ChEMBL | Displacement of [3H]-mibolerone from recombinant wild-type GST-tagged androgen receptor LBD (unknown origin) after 16 hrs by scintillation counting analysis | B | 5.84 | pKi | 1452 | nM | Ki | J Med Chem (2019) 62: 491-511 [PMID:30525603] |
| ChEMBL | Inhibition of androgen receptor (unknown origin) | B | 7.03 | pKi | 93 | nM | Ki | Eur J Med Chem (2020) 205: 112667-112667 [PMID:32911308] |
| ChEMBL | Antagonist activity at androgen receptor (unknown origin) | B | 7.46 | pKi | 34.7 | nM | Ki | Eur J Med Chem (2015) 99: 51-66 [PMID:26046313] |
| ChEMBL | Inhibition of androgen receptor (unknown origin) | B | 6.7 | pIC50 | 200 | nM | IC50 | Eur J Med Chem (2020) 205: 112667-112667 [PMID:32911308] |
| GtoPdb | Antagonism of testosterone-induced activation of wtAR determined using AR-HEK293 cells and a luciferase reporter system.. | - | 6.7 | pIC50 | 200 | nM | IC50 | Sci Rep (2015) 5: 12007 [PMID:26137992] |
| ChEMBL | Antagonist activity at recombinant human AR expressed in HEK293 cells assessed as inhibition of R1881-induced transcriptional activity measured after 24 hrs by dual luciferase reporter gene assay | B | 6.8 | pIC50 | 160 | nM | IC50 | J Med Chem (2020) 63: 12642-12665 [PMID:33095584] |
| GtoPdb | - | - | 6.91 | pIC50 | 122 | nM | IC50 | J Med Chem (2010) 53: 2779-96 [PMID:20218717] |
| ChEMBL | Displacement of [3H]-R1881 from AR in human LNCaP cells preincubated for 30 mins followed by [3H]-R1881 addition measured after 30 mins by microbeta scintillation counter method | B | 7.79 | pIC50 | 16.25 | nM | IC50 | Bioorg Med Chem Lett (2017) 27: 2803-2806 [PMID:28478926] |
| ChEMBL | Antagonist activity at human androgen receptor expressed in HEK293 cells assessed as inhibition of R1881-induced receptor transactivation after 24 hrs by luciferase reporter gene assay | B | 7.8 | pIC50 | 16 | nM | IC50 | J Med Chem (2019) 62: 491-511 [PMID:30525603] |
| Androgen receptor/Androgen Receptor in Rat (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL3072] [GtoPdb: 628] [UniProtKB: P15207] | ||||||||
| ChEMBL | Displacement of [3H]-MIB from wild-type rat AR LBD measured after 16 hrs by scintillation counting method | B | 5.84 | pKi | 1452 | nM | Ki | J Med Chem (2020) 63: 12642-12665 [PMID:33095584] |
| GtoPdb | Binding affinity measured in competition with [3H]mibolerone using wtAR isolated from rat ventral prostates. | - | 7.03 | pKi | 93 | nM | Ki | Sci Rep (2015) 5: 12007 [PMID:26137992] |
ChEMBL data shown on this page come from version 33:
Mendez D, Gaulton A, Bento AP, Chambers J, De Veij M, Félix E, Magariños MP, Mosquera JF, Mutowo P, Nowotka M, Gordillo-Marañón M, Hunter F, Junco L, Mugumbate G, Rodriguez-Lopez M, Atkinson F, Bosc N, Radoux CJ, Segura-Cabrera A, Hersey A, Leach AR. (2019) 'ChEMBL: towards direct deposition of bioassay data' Nucleic Acids Res., 47(D1). DOI: 10.1093/nar/gky1075. [EPMCID:30398643]
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]
