BDBM50292277 CHEMBL269499::Cyclohexanone derivative

SMILES: COC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CC[C@H]1CCC[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(=O)[C@@H](N)Cc2c[nH]c3ccccc23)C(=O)[C@@H](N)Cc2c[nH]c3ccccc23)C1=O)C(=O)[C@@H](N)Cc1c[nH]c2ccccc12)C(=O)[C@H](C)N

InChI Key: InChIKey=UXBRRNFPEDPENO-LMYRGRFFSA-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 = 50292277   

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
Plasminogen (Homo sapiens (Human))	BDBM50292277 (CHEMBL269499 | Cyclohexanone derivative) Show SMILES COC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CC[C@H]1CCC[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(=O)[C@@H](N)Cc2c[nH]c3ccccc23)C(=O)[C@@H](N)Cc2c[nH]c3ccccc23)C1=O)C(=O)[C@@H](N)Cc1c[nH]c2ccccc12)C(=O)[C@H](C)N Show InChI InChI=1S/C62H70N12O13/c1-32(63)53(76)52(61(84)86-2)73-59(82)49(55(78)41(64)25-35-28-67-44-19-9-6-16-38(35)44)71-48(75)24-23-34-15-12-22-47(54(34)77)70-58(81)50(56(79)42(65)26-36-29-68-45-20-10-7-17-39(36)45)72-60(83)51(74-62(85)87-31-33-13-4-3-5-14-33)57(80)43(66)27-37-30-69-46-21-11-8-18-40(37)46/h3-11,13-14,16-21,28-30,32,34,41-43,47,49-52,67-69H,12,15,22-27,31,63-66H2,1-2H3,(H,70,81)(H,71,75)(H,72,83)(H,73,82)(H,74,85)/t32?,34-,41+,42+,43+,47-,49+,50+,51+,52+/m1/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	6.60E+3	n/a	n/a	n/a	n/a	n/a	n/a
Brown University Curated by ChEMBL					Assay Description Inhibitory concentration against plasmin				J Med Chem 48: 6908-17 (2005) Article DOI: 10.1021/jm050488k BindingDB Entry DOI: 10.7270/Q24M959K
					More data for this Ligand-Target Pair