BDBM50355958 CHEMBL1910640

SMILES: CC(C)(C)OC(=O)n1cc(CCC(=O)Nc2cc(ccc2OCc2ccncc2)C(=O)N[C@@H](CCCCN)C#N)c2ccccc12

InChI Key: InChIKey=HVHAHUNFHGIMED-MHZLTWQESA-N

Data: 2 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 2 hits for monomerid = 50355958   

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
Plasma kallikrein (Homo sapiens (Human))	BDBM50355958 (CHEMBL1910640) Show SMILES CC(C)(C)OC(=O)n1cc(CCC(=O)Nc2cc(ccc2OCc2ccncc2)C(=O)N[C@@H](CCCCN)C#N)c2ccccc12 |r| Show InChI InChI=1S/C35H40N6O5/c1-35(2,3)46-34(44)41-22-26(28-9-4-5-10-30(28)41)12-14-32(42)40-29-20-25(33(43)39-27(21-37)8-6-7-17-36)11-13-31(29)45-23-24-15-18-38-19-16-24/h4-5,9-11,13,15-16,18-20,22,27H,6-8,12,14,17,23,36H2,1-3H3,(H,39,43)(H,40,42)/t27-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	9.10E+5	n/a	n/a	n/a	n/a	n/a	n/a
Hiroshima International University Curated by ChEMBL					Assay Description Inhibition of plasma kallikrein				Bioorg Med Chem Lett 21: 6305-9 (2011) Article DOI: 10.1016/j.bmcl.2011.08.121 BindingDB Entry DOI: 10.7270/Q2DR2VX4
					More data for this Ligand-Target Pair
Plasminogen (Homo sapiens (Human))	BDBM50355958 (CHEMBL1910640) Show SMILES CC(C)(C)OC(=O)n1cc(CCC(=O)Nc2cc(ccc2OCc2ccncc2)C(=O)N[C@@H](CCCCN)C#N)c2ccccc12 |r| Show InChI InChI=1S/C35H40N6O5/c1-35(2,3)46-34(44)41-22-26(28-9-4-5-10-30(28)41)12-14-32(42)40-29-20-25(33(43)39-27(21-37)8-6-7-17-36)11-13-31(29)45-23-24-15-18-38-19-16-24/h4-5,9-11,13,15-16,18-20,22,27H,6-8,12,14,17,23,36H2,1-3H3,(H,39,43)(H,40,42)/t27-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.20E+5	n/a	n/a	n/a	n/a	n/a	n/a
Hiroshima International University Curated by ChEMBL					Assay Description Inhibition of plasmin				Bioorg Med Chem Lett 21: 6305-9 (2011) Article DOI: 10.1016/j.bmcl.2011.08.121 BindingDB Entry DOI: 10.7270/Q2DR2VX4
					More data for this Ligand-Target Pair