BDBM50216668 CHEMBL248424::tert-butyl (R)-3-(4-fluorophenyl)-1-((R)-1-methyl-2-oxo-5-phenyl-2,3-dihydro-1H-benzo[e][1,4]diazepin-3-ylamino)-1-oxopropan-2-ylcarbamate

SMILES: CN1c2ccccc2C(=N[C@@H](NC(=O)[C@@H](Cc2ccc(F)cc2)NC(=O)OC(C)(C)C)C1=O)c1ccccc1

InChI Key: InChIKey=BYMVXJMTHDDIQF-BVAGGSTKSA-N

Data: 1 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 1 hit for monomerid = 50216668   

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 9 subunit alpha (Homo sapiens (Human))	BDBM50216668 (CHEMBL248424 | tert-butyl (R)-3-(4-fluorophenyl)-1...) Show SMILES CN1c2ccccc2C(=N[C@@H](NC(=O)[C@@H](Cc2ccc(F)cc2)NC(=O)OC(C)(C)C)C1=O)c1ccccc1 |c:9| Show InChI InChI=1S/C30H31FN4O4/c1-30(2,3)39-29(38)32-23(18-19-14-16-21(31)17-15-19)27(36)34-26-28(37)35(4)24-13-9-8-12-22(24)25(33-26)20-10-6-5-7-11-20/h5-17,23,26H,18H2,1-4H3,(H,32,38)(H,34,36)/t23-,26+/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	71	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 by FRET assay				Bioorg Med Chem Lett 17: 4630-4 (2007) Article DOI: 10.1016/j.bmcl.2007.05.076 BindingDB Entry DOI: 10.7270/Q2HX1CCF
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