BDBM50268981 2,3-dimethyl-N-(2-methylbenzyl)-6-(1H-1,2,4-triazol-1-yl)imidazo[1,2-a]pyridin-8-amine::CHEMBL498026

SMILES: Cc1nc2c(NCc3ccccc3C)cc(cn2c1C)-n1cncn1

InChI Key: InChIKey=SXRFIFLANPJWQC-UHFFFAOYSA-N

Data: 3 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 3 hits for monomerid = 50268981   

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 3A4 (Homo sapiens (Human))	BDBM50268981 (2,3-dimethyl-N-(2-methylbenzyl)-6-(1H-1,2,4-triazo...) Show SMILES Cc1nc2c(NCc3ccccc3C)cc(cn2c1C)-n1cncn1 Show InChI InChI=1S/C19H20N6/c1-13-6-4-5-7-16(13)9-21-18-8-17(25-12-20-11-22-25)10-24-15(3)14(2)23-19(18)24/h4-8,10-12,21H,9H2,1-3H3	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	1.70E+4	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline R&D Curated by ChEMBL					Assay Description Inhibition of CYP3A4 (unknown origin) using diethoxyfluorescein as substrate				Bioorg Med Chem Lett 19: 3602-6 (2009) Article DOI: 10.1016/j.bmcl.2009.04.127 BindingDB Entry DOI: 10.7270/Q2RX9BZV
					More data for this Ligand-Target Pair
Cytochrome P450 3A4 (Homo sapiens (Human))	BDBM50268981 (2,3-dimethyl-N-(2-methylbenzyl)-6-(1H-1,2,4-triazo...) Show SMILES Cc1nc2c(NCc3ccccc3C)cc(cn2c1C)-n1cncn1 Show InChI InChI=1S/C19H20N6/c1-13-6-4-5-7-16(13)9-21-18-8-17(25-12-20-11-22-25)10-24-15(3)14(2)23-19(18)24/h4-8,10-12,21H,9H2,1-3H3	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	3.80E+3	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline R&D Curated by ChEMBL					Assay Description Inhibition of CYP3A4 (unknown origin) using 7-benzyloxyquinoline as substrate				Bioorg Med Chem Lett 19: 3602-6 (2009) Article DOI: 10.1016/j.bmcl.2009.04.127 BindingDB Entry DOI: 10.7270/Q2RX9BZV
					More data for this Ligand-Target Pair
Cytochrome P450 2C9 (Homo sapiens (Human))	BDBM50268981 (2,3-dimethyl-N-(2-methylbenzyl)-6-(1H-1,2,4-triazo...) Show SMILES Cc1nc2c(NCc3ccccc3C)cc(cn2c1C)-n1cncn1 Show InChI InChI=1S/C19H20N6/c1-13-6-4-5-7-16(13)9-21-18-8-17(25-12-20-11-22-25)10-24-15(3)14(2)23-19(18)24/h4-8,10-12,21H,9H2,1-3H3	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	2.90E+3	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline R&D Curated by ChEMBL					Assay Description Inhibition of CYP2C9 (unknown origin)				Bioorg Med Chem Lett 19: 3602-6 (2009) Article DOI: 10.1016/j.bmcl.2009.04.127 BindingDB Entry DOI: 10.7270/Q2RX9BZV
					More data for this Ligand-Target Pair