BDBM50189987 6-phenyl-N-(quinolin-7-yl)nicotinamide::CHEMBL213390::N-quinolin-7-yl-6-phenylnicotinamide

SMILES: O=C(Nc1ccc2cccnc2c1)c1ccc(nc1)-c1ccccc1

InChI Key: InChIKey=FQMMZAXRATYRCZ-UHFFFAOYSA-N

Data: 6 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 6 hits for monomerid = 50189987   

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 1A (Homo sapiens (Human))	BDBM50189987 (6-phenyl-N-(quinolin-7-yl)nicotinamide | CHEMBL213...) Show SMILES O=C(Nc1ccc2cccnc2c1)c1ccc(nc1)-c1ccccc1 Show InChI InChI=1S/C21H15N3O/c25-21(24-18-10-8-16-7-4-12-22-20(16)13-18)17-9-11-19(23-14-17)15-5-2-1-3-6-15/h1-14H,(H,24,25)	PDB MMDB Reactome pathway KEGG B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	>1.80E+4	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Inhibition of cytochrome P450 1A2				Bioorg Med Chem Lett 16: 4533-6 (2006) Article DOI: 10.1016/j.bmcl.2006.06.026 BindingDB Entry DOI: 10.7270/Q20R9P1B
					More data for this Ligand-Target Pair
Cytochrome P450 3A4 (Homo sapiens (Human))	BDBM50189987 (6-phenyl-N-(quinolin-7-yl)nicotinamide | CHEMBL213...) Show SMILES O=C(Nc1ccc2cccnc2c1)c1ccc(nc1)-c1ccccc1 Show InChI InChI=1S/C21H15N3O/c25-21(24-18-10-8-16-7-4-12-22-20(16)13-18)17-9-11-19(23-14-17)15-5-2-1-3-6-15/h1-14H,(H,24,25)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	>1.80E+4	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Inhibition of cytochrome P450 3A4				Bioorg Med Chem Lett 16: 4533-6 (2006) Article DOI: 10.1016/j.bmcl.2006.06.026 BindingDB Entry DOI: 10.7270/Q20R9P1B
					More data for this Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1 (Homo sapiens (Human))	BDBM50189987 (6-phenyl-N-(quinolin-7-yl)nicotinamide | CHEMBL213...) Show SMILES O=C(Nc1ccc2cccnc2c1)c1ccc(nc1)-c1ccccc1 Show InChI InChI=1S/C21H15N3O/c25-21(24-18-10-8-16-7-4-12-22-20(16)13-18)17-9-11-19(23-14-17)15-5-2-1-3-6-15/h1-14H,(H,24,25)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	7.90	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Antagonist activity against human TRPV1 assessed as inhibition of acid-induced calcium influx by FLIPR assay				Bioorg Med Chem Lett 16: 4533-6 (2006) Article DOI: 10.1016/j.bmcl.2006.06.026 BindingDB Entry DOI: 10.7270/Q20R9P1B
					More data for this Ligand-Target Pair
Cytochrome P450 2C9 (Homo sapiens (Human))	BDBM50189987 (6-phenyl-N-(quinolin-7-yl)nicotinamide | CHEMBL213...) Show SMILES O=C(Nc1ccc2cccnc2c1)c1ccc(nc1)-c1ccccc1 Show InChI InChI=1S/C21H15N3O/c25-21(24-18-10-8-16-7-4-12-22-20(16)13-18)17-9-11-19(23-14-17)15-5-2-1-3-6-15/h1-14H,(H,24,25)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	>1.80E+4	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Inhibition of cytochrome P450 2C9				Bioorg Med Chem Lett 16: 4533-6 (2006) Article DOI: 10.1016/j.bmcl.2006.06.026 BindingDB Entry DOI: 10.7270/Q20R9P1B
					More data for this Ligand-Target Pair
Cytochrome P450 2C19 (Homo sapiens (Human))	BDBM50189987 (6-phenyl-N-(quinolin-7-yl)nicotinamide | CHEMBL213...) Show SMILES O=C(Nc1ccc2cccnc2c1)c1ccc(nc1)-c1ccccc1 Show InChI InChI=1S/C21H15N3O/c25-21(24-18-10-8-16-7-4-12-22-20(16)13-18)17-9-11-19(23-14-17)15-5-2-1-3-6-15/h1-14H,(H,24,25)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	>1.80E+4	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Inhibition of cytochrome P450 2C19				Bioorg Med Chem Lett 16: 4533-6 (2006) Article DOI: 10.1016/j.bmcl.2006.06.026 BindingDB Entry DOI: 10.7270/Q20R9P1B
					More data for this Ligand-Target Pair
Cytochrome P450 2D6 (Homo sapiens (Human))	BDBM50189987 (6-phenyl-N-(quinolin-7-yl)nicotinamide | CHEMBL213...) Show SMILES O=C(Nc1ccc2cccnc2c1)c1ccc(nc1)-c1ccccc1 Show InChI InChI=1S/C21H15N3O/c25-21(24-18-10-8-16-7-4-12-22-20(16)13-18)17-9-11-19(23-14-17)15-5-2-1-3-6-15/h1-14H,(H,24,25)	PDB UniProtKB/SwissProt UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	>1.80E+4	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Inhibition of cytochrome P450 2D6				Bioorg Med Chem Lett 16: 4533-6 (2006) Article DOI: 10.1016/j.bmcl.2006.06.026 BindingDB Entry DOI: 10.7270/Q20R9P1B
					More data for this Ligand-Target Pair