BDBM27070 (1R,5S)-3-[(2S)-2-[(tert-butylcarbamoyl)amino]-3,3-dimethylbutanoyl]-N-[(1R)-2-cyclobutyl-1-[(2S,6R)-2,9,9-trimethyl-3,5-dioxa-4-boratricyclo[6.1.1.0^{2,6}]decan-4-yl]ethyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexane-2-carboxamide::boronic acid derivative, 12

SMILES: CC(C)(C)NC(=O)N[C@H](C(=O)N1C[C@H]2[C@@H](C1C(=O)N[C@@H](CC1CCC1)B1O[C@@H]3CC4CC(C4(C)C)[C@]3(C)O1)C2(C)C)C(C)(C)C

InChI Key: InChIKey=FLFNNSUWLVOADM-DDMSQHJNSA-N

Data: 1 KI

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 = 27070   

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
HCV NS3-NS4A Serine Proteinase (Hepatitis C virus (HCV genotype 1a, isolate H))	BDBM27070 ((1R,5S)-3-[(2S)-2-[(tert-butylcarbamoyl)amino]-3,3...) Show SMILES CC(C)(C)NC(=O)N[C@H](C(=O)N1C[C@H]2[C@@H](C1C(=O)N[C@@H](CC1CCC1)B1O[C@@H]3CC4CC(C4(C)C)[C@]3(C)O1)C2(C)C)C(C)(C)C |r| Show InChI InChI=1S/C35H59BN4O5/c1-31(2,3)27(38-30(43)39-32(4,5)6)29(42)40-18-21-25(34(21,9)10)26(40)28(41)37-24(15-19-13-12-14-19)36-44-23-17-20-16-22(33(20,7)8)35(23,11)45-36/h19-27H,12-18H2,1-11H3,(H,37,41)(H2,38,39,43)/t20?,21-,22?,23+,24-,25-,26?,27+,35-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	10	-11.1	n/a	n/a	n/a	n/a	n/a	6.5	30
Schering-Plough Research Institute					Assay Description Proteolytic cleavage of the ester linkage between the Nva (L-norvaline) and the chromophore (PAP) was monitored for change in absorbance at 370 nm. I...				Bioorg Med Chem Lett 19: 180-3 (2009) Article DOI: 10.1016/j.bmcl.2008.10.124 BindingDB Entry DOI: 10.7270/Q2SX6BH6
					More data for this Ligand-Target Pair