Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Cytochrome P450 1A2' and Ligand = 'BDBM50419279'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Cytochrome P450 1A2 (Homo sapiens (Human))	BDBM50419279 (CHEMBL1835918) Show SMILES Cc1nc(no1)-c1ccc(OCC2CN(C2)c2ccc(C)nn2)cc1 Show InChI InChI=1S/C18H19N5O2/c1-12-3-8-17(21-20-12)23-9-14(10-23)11-24-16-6-4-15(5-7-16)18-19-13(2)25-22-18/h3-8,14H,9-11H2,1-2H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca Curated by ChEMBL					Assay Description Inhibition of CYP1A2				Bioorg Med Chem Lett 21: 6031-5 (2011) Article DOI: 10.1016/j.bmcl.2011.08.083 BindingDB Entry DOI: 10.7270/Q2NV9KH9
					More data for this Ligand-Target Pair
Cytochrome P450 1A2 (Homo sapiens (Human))	BDBM50419279 (CHEMBL1835918) Show SMILES Cc1nc(no1)-c1ccc(OCC2CN(C2)c2ccc(C)nn2)cc1 Show InChI InChI=1S/C18H19N5O2/c1-12-3-8-17(21-20-12)23-9-14(10-23)11-24-16-6-4-15(5-7-16)18-19-13(2)25-22-18/h3-8,14H,9-11H2,1-2H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	>5.01E+4	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca Curated by ChEMBL					Assay Description Time dependent inhibition of CYP1A2				Bioorg Med Chem Lett 21: 6031-5 (2011) Article DOI: 10.1016/j.bmcl.2011.08.083 BindingDB Entry DOI: 10.7270/Q2NV9KH9
					More data for this Ligand-Target Pair