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BDBM50307288 2-(2-Carbamimidoyl-benzo[b]thiophen-4-yloxy)-N-(3-methoxy-phenyl)-2-phenylacetamide::CHEMBL603671

SMILES: COc1cccc(NC(=O)C(Oc2cccc3sc(cc23)C(N)=N)c2ccccc2)c1

InChI Key: InChIKey=COPFNINVTDIILJ-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 = 50307288   
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))
BDBM50307288
PNG
(2-(2-Carbamimidoyl-benzo[b]thiophen-4-yloxy)-N-(3-...)
Show SMILES COc1cccc(NC(=O)C(Oc2cccc3sc(cc23)C(N)=N)c2ccccc2)c1
Show InChI InChI=1S/C24H21N3O3S/c1-29-17-10-5-9-16(13-17)27-24(28)22(15-7-3-2-4-8-15)30-19-11-6-12-20-18(19)14-21(31-20)23(25)26/h2-14,22H,1H3,(H3,25,26)(H,27,28)
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PC cid
PC sid
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Article
PubMed
130n/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
Urokinase-type plasminogen activator


(Homo sapiens (Human))
BDBM50307288
PNG
(2-(2-Carbamimidoyl-benzo[b]thiophen-4-yloxy)-N-(3-...)
Show SMILES COc1cccc(NC(=O)C(Oc2cccc3sc(cc23)C(N)=N)c2ccccc2)c1
Show InChI InChI=1S/C24H21N3O3S/c1-29-17-10-5-9-16(13-17)27-24(28)22(15-7-3-2-4-8-15)30-19-11-6-12-20-18(19)14-21(31-20)23(25)26/h2-14,22H,1H3,(H3,25,26)(H,27,28)
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Article
PubMed
170n/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
Coagulation factor X


(Homo sapiens (Human))
BDBM50307288
PNG
(2-(2-Carbamimidoyl-benzo[b]thiophen-4-yloxy)-N-(3-...)
Show SMILES COc1cccc(NC(=O)C(Oc2cccc3sc(cc23)C(N)=N)c2ccccc2)c1
Show InChI InChI=1S/C24H21N3O3S/c1-29-17-10-5-9-16(13-17)27-24(28)22(15-7-3-2-4-8-15)30-19-11-6-12-20-18(19)14-21(31-20)23(25)26/h2-14,22H,1H3,(H3,25,26)(H,27,28)
PDB
MMDB

Reactome pathway
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UniProtKB/SwissProt
UniProtKB/TrEMBL

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

Similars

Article
PubMed
290n/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