BDBM50311133 17beta-[(N-Heptyl)methylamino]-4-methyl-4-aza-5alpha-androstan-3-one::CHEMBL1080041

SMILES: CCCCCCCN(C)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4N(C)C(=O)CC[C@]4(C)[C@H]3CC[C@]12C

InChI Key: InChIKey=NLFGKFYJKFIZBY-QJDMKIOZSA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50311133   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
3-keto-steroid reductase (Homo sapiens (Human))	BDBM50311133 (17beta-[(N-Heptyl)methylamino]-4-methyl-4-aza-5alp...) Show SMILES CCCCCCCN(C)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4N(C)C(=O)CC[C@]4(C)[C@H]3CC[C@]12C |r| Show InChI InChI=1S/C27H48N2O/c1-6-7-8-9-10-19-28(4)23-14-12-21-20-11-13-24-27(3,18-16-25(30)29(24)5)22(20)15-17-26(21,23)2/h20-24H,6-19H2,1-5H3/t20-,21-,22-,23-,24+,26-,27+/m0/s1	Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	189	n/a	n/a	n/a	n/a	n/a	n/a
CHUQ (CHUL) Research Center and Laval University Curated by ChEMBL					Assay Description Inhibition of human 17beta-HSD7 expressed in HEK293 cells assessed as inhibition of reduction of [14C]estrone into [14C]estradiol after 7 hrs				J Med Chem 52: 7488-502 (2009) Article DOI: 10.1021/jm900921c BindingDB Entry DOI: 10.7270/Q2KK9BXD
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