null

SMILES: OC1(CCCC1)c1ccncc1N1CCN(C1=O)c1ccnc(Cl)c1

InChI Key: InChIKey=UGBGCQBSCVYTAK-UHFFFAOYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 158463   

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
Steroid 17-alpha-hydroxylase/17,20 lyase (Homo sapiens (Human))	BDBM158463 (US9029399, 35A | US9339501, 35A) Show SMILES OC1(CCCC1)c1ccncc1N1CCN(C1=O)c1ccnc(Cl)c1 Show InChI InChI=1S/C18H19ClN4O2/c19-16-11-13(3-8-21-16)22-9-10-23(17(22)24)15-12-20-7-4-14(15)18(25)5-1-2-6-18/h3-4,7-8,11-12,25H,1-2,5-6,9-10H2	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	341	n/a	n/a	n/a	n/a	7.5	n/a
NOVARTIS AG US Patent					Assay Description Assay method was adopted from a published protocol with some modifications to suit our requirements (Dmitry N Grigoryev et al, Analytical Biochemistr...				US Patent US9339501 (2016) BindingDB Entry DOI: 10.7270/Q26T0KG2
					More data for this Ligand-Target Pair
Steroid 17-alpha-hydroxylase/17,20 lyase (Homo sapiens (Human))	BDBM158463 (US9029399, 35A | US9339501, 35A) Show SMILES OC1(CCCC1)c1ccncc1N1CCN(C1=O)c1ccnc(Cl)c1 Show InChI InChI=1S/C18H19ClN4O2/c19-16-11-13(3-8-21-16)22-9-10-23(17(22)24)15-12-20-7-4-14(15)18(25)5-1-2-6-18/h3-4,7-8,11-12,25H,1-2,5-6,9-10H2	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	341	n/a	n/a	n/a	n/a	7.5	n/a
Novartis AG US Patent					Assay Description Assay method was adopted from a published protocol with some modifications to suit our requirements (Dmitry N Grigoryev et al, Analytical Biochemistr...				US Patent US9029399 (2015) BindingDB Entry DOI: 10.7270/Q28G8JFD
					More data for this Ligand-Target Pair