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BDBM50115860 6-Fluoro-2-[2-hydroxy-3-(tetrahydro-furan-2-ylmethoxy)-phenyl]-1H-benzoimidazole-5-carboxamidine::CHEMBL62588

SMILES: NC(=N)c1cc2[nH]c(nc2cc1F)-c1cccc(OCC2CCCO2)c1O

InChI Key: InChIKey=YLUBBMAMBPRAKF-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 = 50115860   
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))
BDBM50115860
PNG
(6-Fluoro-2-[2-hydroxy-3-(tetrahydro-furan-2-ylmeth...)
Show SMILES NC(=N)c1cc2[nH]c(nc2cc1F)-c1cccc(OCC2CCCO2)c1O
Show InChI InChI=1S/C19H19FN4O3/c20-13-8-15-14(7-12(13)18(21)22)23-19(24-15)11-4-1-5-16(17(11)25)27-9-10-3-2-6-26-10/h1,4-5,7-8,10,25H,2-3,6,9H2,(H3,21,22)(H,23,24)
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PC sid
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80n/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))
BDBM50115860
PNG
(6-Fluoro-2-[2-hydroxy-3-(tetrahydro-furan-2-ylmeth...)
Show SMILES NC(=N)c1cc2[nH]c(nc2cc1F)-c1cccc(OCC2CCCO2)c1O
Show InChI InChI=1S/C19H19FN4O3/c20-13-8-15-14(7-12(13)18(21)22)23-19(24-15)11-4-1-5-16(17(11)25)27-9-10-3-2-6-26-10/h1,4-5,7-8,10,25H,2-3,6,9H2,(H3,21,22)(H,23,24)
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4.20E+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))
BDBM50115860
PNG
(6-Fluoro-2-[2-hydroxy-3-(tetrahydro-furan-2-ylmeth...)
Show SMILES NC(=N)c1cc2[nH]c(nc2cc1F)-c1cccc(OCC2CCCO2)c1O
Show InChI InChI=1S/C19H19FN4O3/c20-13-8-15-14(7-12(13)18(21)22)23-19(24-15)11-4-1-5-16(17(11)25)27-9-10-3-2-6-26-10/h1,4-5,7-8,10,25H,2-3,6,9H2,(H3,21,22)(H,23,24)
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1.30E+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
Prothrombin


(Homo sapiens (Human))
BDBM50115860
PNG
(6-Fluoro-2-[2-hydroxy-3-(tetrahydro-furan-2-ylmeth...)
Show SMILES NC(=N)c1cc2[nH]c(nc2cc1F)-c1cccc(OCC2CCCO2)c1O
Show InChI InChI=1S/C19H19FN4O3/c20-13-8-15-14(7-12(13)18(21)22)23-19(24-15)11-4-1-5-16(17(11)25)27-9-10-3-2-6-26-10/h1,4-5,7-8,10,25H,2-3,6,9H2,(H3,21,22)(H,23,24)
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2.00E+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
Tissue-type plasminogen activator


(Homo sapiens (Human))
BDBM50115860
PNG
(6-Fluoro-2-[2-hydroxy-3-(tetrahydro-furan-2-ylmeth...)
Show SMILES NC(=N)c1cc2[nH]c(nc2cc1F)-c1cccc(OCC2CCCO2)c1O
Show InChI InChI=1S/C19H19FN4O3/c20-13-8-15-14(7-12(13)18(21)22)23-19(24-15)11-4-1-5-16(17(11)25)27-9-10-3-2-6-26-10/h1,4-5,7-8,10,25H,2-3,6,9H2,(H3,21,22)(H,23,24)
PDB
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NCI pathway
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PubMed
4.50E+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