BDBM132225 USRE45173, 164A::USRE45173, 201A

SMILES: CC1(C)CN(C(=O)N1c1cccnc1)c1ccc2ncsc2c1

InChI Key: InChIKey=MQBKOTVBYVNCAE-UHFFFAOYSA-N

Data: 2 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 2 hits for monomerid = 132225   

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
Cytochrome P450 17A1 (Homo sapiens (Human))	BDBM132225 (USRE45173, 164A | USRE45173, 201A) Show SMILES CC1(C)CN(C(=O)N1c1cccnc1)c1ccc2ncsc2c1 Show InChI InChI=1S/C17H16N4OS/c1-17(2)10-20(12-5-6-14-15(8-12)23-11-19-14)16(22)21(17)13-4-3-7-18-9-13/h3-9,11H,10H2,1-2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	70	n/a	n/a	n/a	n/a	n/a	n/a
Novartis AG US Patent					Assay Description Cytochrome P450, 17-20 lyase (CYP17-lyase) assay development using recombinant human CYP17 enzyme and 17-alpha -hydroxy pregnenolone [21-3H] as the s...				US Patent USRE45173 (2014) BindingDB Entry DOI: 10.7270/Q2MW2FT2
					More data for this Ligand-Target Pair
Cytochrome P450 17A1 (Homo sapiens (Human))	BDBM132225 (USRE45173, 164A | USRE45173, 201A) Show SMILES CC1(C)CN(C(=O)N1c1cccnc1)c1ccc2ncsc2c1 Show InChI InChI=1S/C17H16N4OS/c1-17(2)10-20(12-5-6-14-15(8-12)23-11-19-14)16(22)21(17)13-4-3-7-18-9-13/h3-9,11H,10H2,1-2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	70	n/a	n/a	n/a	n/a	n/a	n/a
Novartis AG US Patent					Assay Description Cytochrome P450, 17-20 lyase (CYP17-lyase) assay development using recombinant human CYP17 enzyme and 17-alpha -hydroxy pregnenolone [21-3H] as the s...				US Patent USRE45173 (2014) BindingDB Entry DOI: 10.7270/Q2MW2FT2
					More data for this Ligand-Target Pair