BDBM50233780 (R)-tert-butyl 1-((3-benzyl-3H-imidazo[4,5-b]pyridin-2-yl)methylamino)-1-oxo-3-(2-(trifluoromethyl)phenyl)propan-2-ylcarbamate::CHEMBL254497

SMILES: CC(C)(C)OC(=O)N[C@H](Cc1ccccc1C(F)(F)F)C(=O)NCc1nc2cccnc2n1Cc1ccccc1

InChI Key: InChIKey=YTHVKXJUOMIOFP-HSZRJFAPSA-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 = 50233780   

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
Sodium channel protein type 10 subunit alpha (Homo sapiens (Human))	BDBM50233780 ((R)-tert-butyl 1-((3-benzyl-3H-imidazo[4,5-b]pyrid...) Show SMILES CC(C)(C)OC(=O)N[C@H](Cc1ccccc1C(F)(F)F)C(=O)NCc1nc2cccnc2n1Cc1ccccc1 Show InChI InChI=1S/C29H30F3N5O3/c1-28(2,3)40-27(39)36-23(16-20-12-7-8-13-21(20)29(30,31)32)26(38)34-17-24-35-22-14-9-15-33-25(22)37(24)18-19-10-5-4-6-11-19/h4-15,23H,16-18H2,1-3H3,(H,34,38)(H,36,39)/t23-/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	270	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Blockade of human Nav1.8 channel expressed in HEK293 cells by FRET assay				Bioorg Med Chem Lett 18: 1696-701 (2008) Article DOI: 10.1016/j.bmcl.2008.01.047 BindingDB Entry DOI: 10.7270/Q2S46STP
					More data for this Ligand-Target Pair
Cytochrome P450 3A4 (Homo sapiens (Human))	BDBM50233780 ((R)-tert-butyl 1-((3-benzyl-3H-imidazo[4,5-b]pyrid...) Show SMILES CC(C)(C)OC(=O)N[C@H](Cc1ccccc1C(F)(F)F)C(=O)NCc1nc2cccnc2n1Cc1ccccc1 Show InChI InChI=1S/C29H30F3N5O3/c1-28(2,3)40-27(39)36-23(16-20-12-7-8-13-21(20)29(30,31)32)26(38)34-17-24-35-22-14-9-15-33-25(22)37(24)18-19-10-5-4-6-11-19/h4-15,23H,16-18H2,1-3H3,(H,34,38)(H,36,39)/t23-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	980	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Inhibition of CYP3A4				Bioorg Med Chem Lett 18: 1696-701 (2008) Article DOI: 10.1016/j.bmcl.2008.01.047 BindingDB Entry DOI: 10.7270/Q2S46STP
					More data for this Ligand-Target Pair
Sodium channel protein type 9 subunit alpha (Homo sapiens (Human))	BDBM50233780 ((R)-tert-butyl 1-((3-benzyl-3H-imidazo[4,5-b]pyrid...) Show SMILES CC(C)(C)OC(=O)N[C@H](Cc1ccccc1C(F)(F)F)C(=O)NCc1nc2cccnc2n1Cc1ccccc1 Show InChI InChI=1S/C29H30F3N5O3/c1-28(2,3)40-27(39)36-23(16-20-12-7-8-13-21(20)29(30,31)32)26(38)34-17-24-35-22-14-9-15-33-25(22)37(24)18-19-10-5-4-6-11-19/h4-15,23H,16-18H2,1-3H3,(H,34,38)(H,36,39)/t23-/m1/s1	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	80	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Blockade of human Nav1.7 channel expressed in HEK293 cells by FRET assay				Bioorg Med Chem Lett 18: 1696-701 (2008) Article DOI: 10.1016/j.bmcl.2008.01.047 BindingDB Entry DOI: 10.7270/Q2S46STP
					More data for this Ligand-Target Pair