BDBM50368380 CHEMBL1202123

SMILES: [#7]-[#6](-[#6]-c1ccc2ccccc2c1)-[#6](=O)-[#7]-1-[#6]-[#6]-[#6]-[#6@H]-1-[#6](=O)-[#7]-[#6](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#6](=O)-[#6]-[#6]-[#6](=O)-[#7]-1-[#6]-[#6]-[#6]-[#6]-[#6]-1

InChI Key: InChIKey=ZDRVDBOFEUWCDY-RCSZBHJWSA-N

Data: 1 KI

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 = 50368380   

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
Prothrombin (Homo sapiens (Human))	BDBM50368380 (CHEMBL1202123) Show SMILES [#7]-[#6](-[#6]-c1ccc2ccccc2c1)-[#6](=O)-[#7]-1-[#6]-[#6]-[#6]-[#6@H]-1-[#6](=O)-[#7]-[#6](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#6](=O)-[#6]-[#6]-[#6](=O)-[#7]-1-[#6]-[#6]-[#6]-[#6]-[#6]-1 |r| Show InChI InChI=1S/C32H45N7O4/c33-25(21-22-12-13-23-8-2-3-9-24(23)20-22)31(43)39-19-7-11-27(39)30(42)37-26(10-6-16-36-32(34)35)28(40)14-15-29(41)38-17-4-1-5-18-38/h2-3,8-9,12-13,20,25-27H,1,4-7,10-11,14-19,21,33H2,(H,37,42)(H4,34,35,36)/t25?,26?,27-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	1.16E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Thrombosis Research Institute Curated by ChEMBL					Assay Description In vitro inhibitory activity against thrombin				J Med Chem 35: 3364-9 (1992) BindingDB Entry DOI: 10.7270/Q2RX9CPP
					More data for this Ligand-Target Pair