BDBM210833 US9290467, 3

SMILES: O=C(NC1(CC1)C#N)[C@@H]1Cc2ccc(OC\C=C\CCc3ccccc3C(=O)N1)cc2

InChI Key: InChIKey=NRSUXCKUQVXILT-QDUPWBSZSA-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 = 210833   

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
Procathepsin L (Homo sapiens (Human))	BDBM210833 (US9290467, 3) Show SMILES O=C(NC1(CC1)C#N)[C@@H]1Cc2ccc(OC\C=C\CCc3ccccc3C(=O)N1)cc2 |r,t:17| Show InChI InChI=1S/C25H25N3O3/c26-17-25(13-14-25)28-24(30)22-16-18-9-11-20(12-10-18)31-15-5-1-2-6-19-7-3-4-8-21(19)23(29)27-22/h1,3-5,7-12,22H,2,6,13-16H2,(H,27,29)(H,28,30)/b5-1+/t22-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	77	n/a	n/a	n/a	n/a	6.5	n/a
HOFFMANN—LA ROCHE INC. US Patent					Assay Description Enzyme activity is measured by observing the increase in fluorescence intensity caused by cleavage of a peptide substrate containing a fluorophore wh...				US Patent US9290467 (2016) BindingDB Entry DOI: 10.7270/Q2H130VZ
					More data for this Ligand-Target Pair