Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 437.5 BDBM50092337Purchase

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB (change energy unit to kcal/mol)

Found 1 hit in this display   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Plasminogen (Homo sapiens (Human))	BDBM50092337 ((4-{2-[(4-Aminomethyl-cyclohexanecarbonyl)-amino]-...) Show SMILES NC[C@H]1CC[C@@H](CC1)C(=O)NC(Cc1ccccc1)C(=O)Nc1ccc(CC(O)=O)cc1 |wU:2.1,wD:5.8,(2.07,-8.95,;3.4,-9.72,;4.74,-8.95,;4.74,-7.41,;6.07,-6.64,;7.4,-7.41,;7.4,-8.95,;6.07,-9.72,;8.74,-6.64,;8.74,-5.1,;10.07,-7.41,;11.4,-6.64,;11.4,-5.1,;12.74,-4.33,;12.74,-2.79,;14.07,-2.02,;15.4,-2.79,;15.4,-4.33,;14.07,-5.1,;12.74,-7.41,;12.74,-8.95,;14.07,-6.64,;15.4,-7.41,;16.74,-6.64,;18.07,-7.41,;18.07,-8.95,;19.41,-9.72,;19.41,-11.26,;18.07,-12.03,;20.74,-12.03,;16.74,-9.72,;15.4,-8.95,)| Show InChI InChI=1S/C25H31N3O4/c26-16-19-6-10-20(11-7-19)24(31)28-22(14-17-4-2-1-3-5-17)25(32)27-21-12-8-18(9-13-21)15-23(29)30/h1-5,8-9,12-13,19-20,22H,6-7,10-11,14-16,26H2,(H,27,32)(H,28,31)(H,29,30)/t19-,20-,22?	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL KEGG PC cid PC sid UniChem Patents	PubMed	n/a	n/a	6.20E+5	n/a	n/a	n/a	n/a	n/a	n/a
Kobe Gakuin University Curated by ChEMBL					Assay Description Inhibitory activity of compound was evaluated against plasmin				Bioorg Med Chem Lett 10: 2217-21 (2001) BindingDB Entry DOI: 10.7270/Q2125RXQ
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