BDBM226056 GTC000044A

SMILES: C[C@H](N1CC[C@H](N(C)S(=O)(=O)\C=C\c2ccc(Cl)s2)C1=O)C(=O)N1CCOCC1

InChI Key: InChIKey=KTWAMXPFGPDANL-XZSJCOBXSA-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 = 226056   

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))	BDBM226056 (GTC000044A) Show SMILES C[C@H](N1CC[C@H](N(C)S(=O)(=O)\C=C\c2ccc(Cl)s2)C1=O)C(=O)N1CCOCC1 Show InChI InChI=1S/C18H24ClN3O5S2/c1-13(17(23)21-8-10-27-11-9-21)22-7-5-15(18(22)24)20(2)29(25,26)12-6-14-3-4-16(19)28-14/h3-4,6,12-13,15H,5,7-11H2,1-2H3/b12-6+/t13-,15-/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	44.7	n/a	n/a	n/a	n/a	n/a	n/a
D3R					Assay Description D3R246				D3R 246: (2015) BindingDB Entry DOI: 10.7270/Q2BV7FGN
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM226056 (GTC000044A) Show SMILES C[C@H](N1CC[C@H](N(C)S(=O)(=O)\C=C\c2ccc(Cl)s2)C1=O)C(=O)N1CCOCC1 Show InChI InChI=1S/C18H24ClN3O5S2/c1-13(17(23)21-8-10-27-11-9-21)22-7-5-15(18(22)24)20(2)29(25,26)12-6-14-3-4-16(19)28-14/h3-4,6,12-13,15H,5,7-11H2,1-2H3/b12-6+/t13-,15-/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	405	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