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BDBM50307333 4-(Benzothiazol-2-ylmethoxy)-benzo[b]thiophene-2-carboxamidine::CHEMBL611376

SMILES: NC(=N)c1cc2c(OCc3nc4ccccc4s3)cccc2s1

InChI Key: InChIKey=NWOWVTPJLDDLDQ-UHFFFAOYSA-N

Data: 2 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 2 hits for monomerid = 50307333   
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 IX


(Homo sapiens (Human))
BDBM50307333
PNG
(4-(Benzothiazol-2-ylmethoxy)-benzo[b]thiophene-2-c...)
Show SMILES NC(=N)c1cc2c(OCc3nc4ccccc4s3)cccc2s1
Show InChI InChI=1S/C17H13N3OS2/c18-17(19)15-8-10-12(5-3-7-13(10)22-15)21-9-16-20-11-4-1-2-6-14(11)23-16/h1-8H,9H2,(H3,18,19)
PDB
MMDB

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CHEMBL
PC cid
PC sid
UniChem

Patents

Article
PubMed
800n/an/an/an/an/an/an/an/a



Trigen Ltd.

Curated by ChEMBL


Assay Description
Inhibition of human recombinant factor 9a by amidolytic assay


J Med Chem 53: 1465-72 (2010)


Article DOI: 10.1021/jm901475e
BindingDB Entry DOI: 10.7270/Q22N5372
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM50307333
PNG
(4-(Benzothiazol-2-ylmethoxy)-benzo[b]thiophene-2-c...)
Show SMILES NC(=N)c1cc2c(OCc3nc4ccccc4s3)cccc2s1
Show InChI InChI=1S/C17H13N3OS2/c18-17(19)15-8-10-12(5-3-7-13(10)22-15)21-9-16-20-11-4-1-2-6-14(11)23-16/h1-8H,9H2,(H3,18,19)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

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

Patents

Article
PubMed
2.60E+3n/an/an/an/an/an/an/an/a



Trigen Ltd.

Curated by ChEMBL


Assay Description
Inhibition of factor 10 by amidolytic assay


J Med Chem 53: 1465-72 (2010)


Article DOI: 10.1021/jm901475e
BindingDB Entry DOI: 10.7270/Q22N5372
More data for this
Ligand-Target Pair