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BDBM50115862 6-Chloro-2-(3-ethoxy-2-hydroxy-phenyl)-1H-benzoimidazole-5-carboxamidine::CHEMBL62378

SMILES: CCOc1cccc(-c2nc3cc(Cl)c(cc3[nH]2)C(N)=N)c1O

InChI Key: InChIKey=MVJNDSWMVMZCPN-UHFFFAOYSA-N

Data: 5 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 5 hits for monomerid = 50115862   
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
Urokinase-type plasminogen activator


(Homo sapiens (Human))
BDBM50115862
PNG
(6-Chloro-2-(3-ethoxy-2-hydroxy-phenyl)-1H-benzoimi...)
Show SMILES CCOc1cccc(-c2nc3cc(Cl)c(cc3[nH]2)C(N)=N)c1O
Show InChI InChI=1S/C16H15ClN4O2/c1-2-23-13-5-3-4-8(14(13)22)16-20-11-6-9(15(18)19)10(17)7-12(11)21-16/h3-7,22H,2H2,1H3,(H3,18,19)(H,20,21)
PDB
MMDB

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PC sid
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PubMed
950n/an/an/an/an/an/an/an/a



Celera

Curated by ChEMBL


Assay Description
Inhibition of urokinase-type plasminogen activator


Bioorg Med Chem Lett 12: 2019-22 (2002)


BindingDB Entry DOI: 10.7270/Q237782T
More data for this
Ligand-Target Pair
Plasminogen


(Homo sapiens (Human))
BDBM50115862
PNG
(6-Chloro-2-(3-ethoxy-2-hydroxy-phenyl)-1H-benzoimi...)
Show SMILES CCOc1cccc(-c2nc3cc(Cl)c(cc3[nH]2)C(N)=N)c1O
Show InChI InChI=1S/C16H15ClN4O2/c1-2-23-13-5-3-4-8(14(13)22)16-20-11-6-9(15(18)19)10(17)7-12(11)21-16/h3-7,22H,2H2,1H3,(H3,18,19)(H,20,21)
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PubMed
1.60E+3n/an/an/an/an/an/an/an/a



Celera

Curated by ChEMBL


Assay Description
Inhibition of plasmin


Bioorg Med Chem Lett 12: 2019-22 (2002)


BindingDB Entry DOI: 10.7270/Q237782T
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM50115862
PNG
(6-Chloro-2-(3-ethoxy-2-hydroxy-phenyl)-1H-benzoimi...)
Show SMILES CCOc1cccc(-c2nc3cc(Cl)c(cc3[nH]2)C(N)=N)c1O
Show InChI InChI=1S/C16H15ClN4O2/c1-2-23-13-5-3-4-8(14(13)22)16-20-11-6-9(15(18)19)10(17)7-12(11)21-16/h3-7,22H,2H2,1H3,(H3,18,19)(H,20,21)
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>7.50E+4n/an/an/an/an/an/an/an/a



Celera

Curated by ChEMBL


Assay Description
Inhibition of Coagulation factor X


Bioorg Med Chem Lett 12: 2019-22 (2002)


BindingDB Entry DOI: 10.7270/Q237782T
More data for this
Ligand-Target Pair
Tissue-type plasminogen activator


(Homo sapiens (Human))
BDBM50115862
PNG
(6-Chloro-2-(3-ethoxy-2-hydroxy-phenyl)-1H-benzoimi...)
Show SMILES CCOc1cccc(-c2nc3cc(Cl)c(cc3[nH]2)C(N)=N)c1O
Show InChI InChI=1S/C16H15ClN4O2/c1-2-23-13-5-3-4-8(14(13)22)16-20-11-6-9(15(18)19)10(17)7-12(11)21-16/h3-7,22H,2H2,1H3,(H3,18,19)(H,20,21)
PDB
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NCI pathway
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PubMed
>7.50E+4n/an/an/an/an/an/an/an/a



Celera

Curated by ChEMBL


Assay Description
Inhibition of tissue-type plasminogen activator


Bioorg Med Chem Lett 12: 2019-22 (2002)


BindingDB Entry DOI: 10.7270/Q237782T
More data for this
Ligand-Target Pair
Prothrombin


(Homo sapiens (Human))
BDBM50115862
PNG
(6-Chloro-2-(3-ethoxy-2-hydroxy-phenyl)-1H-benzoimi...)
Show SMILES CCOc1cccc(-c2nc3cc(Cl)c(cc3[nH]2)C(N)=N)c1O
Show InChI InChI=1S/C16H15ClN4O2/c1-2-23-13-5-3-4-8(14(13)22)16-20-11-6-9(15(18)19)10(17)7-12(11)21-16/h3-7,22H,2H2,1H3,(H3,18,19)(H,20,21)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
>7.50E+4n/an/an/an/an/an/an/an/a



Celera

Curated by ChEMBL


Assay Description
Inhibition of thrombin


Bioorg Med Chem Lett 12: 2019-22 (2002)


BindingDB Entry DOI: 10.7270/Q237782T
More data for this
Ligand-Target Pair