BDBM226025 GTC000013A

SMILES: COC(=O)CN([C@H]1CCN([C@@H](C)C(=O)N2CCOCC2)C1=O)S(=O)(=O)\C=C\c1ccc(Cl)cc1

InChI Key: InChIKey=ZLGPXHQZLGUYEO-WTCBMFSRSA-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 = 226025   

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
Coagulation factor X (Homo sapiens (Human))	BDBM226025 (GTC000013A) Show SMILES COC(=O)CN([C@H]1CCN([C@@H](C)C(=O)N2CCOCC2)C1=O)S(=O)(=O)\C=C\c1ccc(Cl)cc1 Show InChI InChI=1S/C22H28ClN3O7S/c1-16(21(28)24-10-12-33-13-11-24)25-9-7-19(22(25)29)26(15-20(27)32-2)34(30,31)14-8-17-3-5-18(23)6-4-17/h3-6,8,14,16,19H,7,9-13,15H2,1-2H3/b14-8+/t16-,19-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	D3R	n/a	n/a	60	n/a	n/a	n/a	n/a	n/a	n/a
D3R					Assay Description D3R245				D3R 245: (2015) BindingDB Entry DOI: 10.7270/Q2GM865X
					More data for this Ligand-Target Pair