BindingDB logo
myBDB logout

BDBM50358871 CHEMBL1923457

SMILES: Clc1ccc2cc(sc2n1)S(=O)(=O)N[C@H]1CCCN(CC(=O)N2CCCC2)C1=O

InChI Key: InChIKey=RPCVORVROHQXIR-ZDUSSCGKSA-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 = 50358871   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Coagulation factor X


(Homo sapiens (Human))
BDBM50358871
PNG
(CHEMBL1923457)
Show SMILES Clc1ccc2cc(sc2n1)S(=O)(=O)N[C@H]1CCCN(CC(=O)N2CCCC2)C1=O |r|
Show InChI InChI=1S/C18H21ClN4O4S2/c19-14-6-5-12-10-16(28-17(12)20-14)29(26,27)21-13-4-3-9-23(18(13)25)11-15(24)22-7-1-2-8-22/h5-6,10,13,21H,1-4,7-9,11H2/t13-/m0/s1
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents

Article
PubMed
n/an/a 14n/an/an/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
Inhibition of human factor 10a using phenyl-Ile-Glu-Gly-Arg-pNA as substrate preincubated for 3 mins prior to substrate addition by spectrophotometry


Bioorg Med Chem Lett 21: 7516-21 (2011)


Article DOI: 10.1016/j.bmcl.2011.06.098
BindingDB Entry DOI: 10.7270/Q2MK6DBS
More data for this
Ligand-Target Pair