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BDBM50307295 4-(2-Benzylamino-1-phenyl-ethoxy)-benzo[b]thiophene-2-carboxamidine::CHEMBL599001

SMILES: NC(=N)c1cc2c(OC(CNCc3ccccc3)c3ccccc3)cccc2s1

InChI Key: InChIKey=NFJBOMRZPXKWOS-UHFFFAOYSA-N

Data: 3 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 3 hits for monomerid = 50307295   
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))
BDBM50307295
PNG
(4-(2-Benzylamino-1-phenyl-ethoxy)-benzo[b]thiophen...)
Show SMILES NC(=N)c1cc2c(OC(CNCc3ccccc3)c3ccccc3)cccc2s1
Show InChI InChI=1S/C24H23N3OS/c25-24(26)23-14-19-20(12-7-13-22(19)29-23)28-21(18-10-5-2-6-11-18)16-27-15-17-8-3-1-4-9-17/h1-14,21,27H,15-16H2,(H3,25,26)
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Article
PubMed
100n/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: 1473-82 (2010)


Article DOI: 10.1021/jm901476x
BindingDB Entry DOI: 10.7270/Q2P84C0N
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM50307295
PNG
(4-(2-Benzylamino-1-phenyl-ethoxy)-benzo[b]thiophen...)
Show SMILES NC(=N)c1cc2c(OC(CNCc3ccccc3)c3ccccc3)cccc2s1
Show InChI InChI=1S/C24H23N3OS/c25-24(26)23-14-19-20(12-7-13-22(19)29-23)28-21(18-10-5-2-6-11-18)16-27-15-17-8-3-1-4-9-17/h1-14,21,27H,15-16H2,(H3,25,26)
PDB
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Article
PubMed
250n/an/an/an/an/an/an/an/a



Trigen Ltd.

Curated by ChEMBL


Assay Description
Inhibition of factor 10a by amidolytic assay


J Med Chem 53: 1473-82 (2010)


Article DOI: 10.1021/jm901476x
BindingDB Entry DOI: 10.7270/Q2P84C0N
More data for this
Ligand-Target Pair
Urokinase-type plasminogen activator


(Homo sapiens (Human))
BDBM50307295
PNG
(4-(2-Benzylamino-1-phenyl-ethoxy)-benzo[b]thiophen...)
Show SMILES NC(=N)c1cc2c(OC(CNCc3ccccc3)c3ccccc3)cccc2s1
Show InChI InChI=1S/C24H23N3OS/c25-24(26)23-14-19-20(12-7-13-22(19)29-23)28-21(18-10-5-2-6-11-18)16-27-15-17-8-3-1-4-9-17/h1-14,21,27H,15-16H2,(H3,25,26)
PDB
MMDB

Reactome pathway
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UniProtKB/TrEMBL

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CHEMBL
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PC sid
UniChem

Patents


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Article
PubMed
310n/an/an/an/an/an/an/an/a



Trigen Ltd.

Curated by ChEMBL


Assay Description
Inhibition of uPA


J Med Chem 53: 1473-82 (2010)


Article DOI: 10.1021/jm901476x
BindingDB Entry DOI: 10.7270/Q2P84C0N
More data for this
Ligand-Target Pair