androstenedione [Ligand Id: 2860] activity data from GtoPdb and ChEMBL

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ChEMBL ligand: CHEMBL274826 (Androstenedione)
  • Androgen receptor/Androgen Receptor in Rat [ChEMBL: CHEMBL3072] [GtoPdb: 628] [UniProtKB: P15207]
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  • Corticosteroid binding globulin in Human [ChEMBL: CHEMBL2421] [UniProtKB: P08185]
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  • Estradiol 17-beta-dehydrogenase 3 in Human [ChEMBL: CHEMBL4234] [UniProtKB: P37058]
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  • Testis-specific androgen-binding protein in Human [ChEMBL: CHEMBL3305] [UniProtKB: P04278]
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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 Rat (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL3072] [GtoPdb: 628] [UniProtKB: P15207]
ChEMBL Inhibitory concentration against recombinant rat androgen receptor expressed in Escherichia coli using [3H]methyltrienolone (R 1881) B 5.89 pIC50 1288.25 nM IC50 J. Med. Chem. (2005) 48: 5666-5674 [PMID:16134935]
ChEMBL In vitro antagonist activity against rat prostatic androgen receptor (AR) F 7.19 pIC50 64 nM IC50 J. Med. Chem. (1986) 29: 2298-2315 [PMID:3783591]
GtoPdb - - 8.56 pIC50 - - - Chem. Res. Toxicol. (2003) 16: 1338-58 [PMID:14565775]
Corticosteroid binding globulin in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL2421] [UniProtKB: P08185]
ChEMBL In silico binding affinity to human corticosteriod binding globulin B 4.76 pKd 4.76 - -Log Kdiss J. Med. Chem. (1997) 40: 3161-3172 [PMID:9379435]
ChEMBL Binding affinity to human CBG receptor (corticosteroid-binding globulins) B 5.76 pKi 1737.8 nM Ki J. Med. Chem. (2004) 47: 2732-2742 [PMID:15139751]
CYP19A1/Cytochrome P450 19A1 in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL1978] [GtoPdb: 1362] [UniProtKB: P11511]
ChEMBL Competitive inhibition of human aromatase extracted from placental microsomes after 5 mins by Dixon plot analysis in presence of [1beta-3H]AD B 7.46 pKi 35 nM Ki Eur. J. Med. Chem. (2015) 105: 1-38 [PMID:26469743]
ChEMBL Binding affinity for aromatase cytochrome P45019A1 by analysis of Dixon plot B 7.7 pKi 20 nM Ki J. Med. Chem. (1994) 37: 2198-2205 [PMID:8035427]
ChEMBL In vitro competitive inhibitory activity was measured on Cytochrome P450 19A1 of human placental microsomes B 6.52 pIC50 300 nM IC50 J. Med. Chem. (1994) 37: 2198-2205 [PMID:8035427]
ChEMBL Inhibition of aromatase B 6.59 pIC50 >=260 nM IC50 Bioorg. Med. Chem. (2012) 20: 2603-2613 [PMID:22444875]
Estradiol 17-beta-dehydrogenase 3 in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL4234] [UniProtKB: P37058]
ChEMBL Inhibitory concentration against type-3 17-beta-HSD expressed in HEK293 cells B 6.12 pIC50 758 nM IC50 Bioorg. Med. Chem. Lett. (2000) 10: 2533-2536 [PMID:11086723]
ChEMBL Ability to inhibit the Type-3 17-beta- hydroxysteroid dehydrogenase activity transfected in human embryonic kidney (HEK)-293 cells experiment 1 B 6.12 pIC50 758 nM IC50 J. Med. Chem. (2002) 45: 640-653 [PMID:11806715]
ChEMBL Inhibition of type-3 17 beta-hydroxysteroid dehydrogenase expressed in HEK293 cells at 37 degree C pH7.4 B 6.12 pIC50 758 nM IC50 J. Med. Chem. (2005) 48: 5257-5268 [PMID:16078844]
ChEMBL Ability to inhibit the Type-3 17-beta- hydroxysteroid dehydrogenase activity transfected in human embryonic kidney (HEK)-293 cells experiment 2 B 6.19 pIC50 650 nM IC50 J. Med. Chem. (2002) 45: 640-653 [PMID:11806715]
ChEMBL Ability to inhibit the Type-3 17-beta- hydroxysteroid dehydrogenase activity transfected in human embryonic kidney (HEK)-293 cells experiment 3 B 6.31 pIC50 489 nM IC50 J. Med. Chem. (2002) 45: 640-653 [PMID:11806715]
Plasmodium falciparum (target type: ORGANISM) [ChEMBL: CHEMBL364]
ChEMBL Antiplasmodial activity against Plasmodium falciparum W2 after 72 hrs by SYBR green assay F 5 pIC50 10000 nM IC50 Nat. Chem. Biol. (2009) 5: 765-771 [PMID:19734910]
Testis-specific androgen-binding protein in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL3305] [UniProtKB: P04278]
ChEMBL Binding affinity towards human testosterone binding globulin. B 6.46 pKd 6.46 - -Log Kdiss J. Med. Chem. (1997) 40: 3161-3172 [PMID:9379435]
ChEMBL Displacement of [3H]5alpha dihydrotestosterone from human sex hormone binding globulin B 7.46 pKd 34.67 nM Kd J. Med. Chem. (2008) 51: 2047-2056 [PMID:18330978]
Testosterone 17-beta-dehydrogenase 3 in Rat (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL1075158] [UniProtKB: O54939]
ChEMBL Inhibition of 17beta-HSD3 in rat testes microsomes using [14C]-4-androstene-3,17-dione as substrate after 2 hrs B 6.77 pIC50 169 nM IC50 Bioorg. Med. Chem. (2015) 23: 5433-5451 [PMID:26277760]

ChEMBL data shown on this page come from version 27:

Gaulton A, Hersey A, Nowotka M, Bento AP, Chambers J, Mendez D, Mutowo P, Atkinson F, Bellis LJ, CibriƔn-Uhalte E, Davies M, Dedman N, Karlsson A, MagariƱos MP, Overington JP, Papadatos G, Smit I, Leach AR. (2017) 'The ChEMBL database in 2017.' Nucleic Acids Res., 45(D1). DOI: 10.1093/nar/gkw1074. [PMCID:5210557]