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SMILES: Fc1cccc2OCCC(c12)n1c2nc(ncc2[nH]c1=O)-n1cnc2ccccc12

InChI Key: InChIKey=GWIYWVOOKZDFBH-UHFFFAOYSA-N

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   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50311647   
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
Tyrosine-protein kinase JAK2


(Homo sapiens (Human))
BDBM50311647
PNG
((+/-)-2-(1H-benzo[d]imidazol-1-yl)-9-(5-fluorochro...)
Show SMILES Fc1cccc2OCCC(c12)n1c2nc(ncc2[nH]c1=O)-n1cnc2ccccc12
Show InChI InChI=1S/C21H15FN6O2/c22-12-4-3-7-17-18(12)16(8-9-30-17)28-19-14(25-21(28)29)10-23-20(26-19)27-11-24-13-5-1-2-6-15(13)27/h1-7,10-11,16H,8-9H2,(H,25,29)
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Article
PubMed
n/an/a 97n/an/an/an/an/an/a



Ligand Pharmaceuticals, Inc

Curated by ChEMBL


Assay Description
Inhibition of human JAK2 (532-1132) by time resolved fluorescence assay


Bioorg Med Chem Lett 19: 6788-92 (2009)


Article DOI: 10.1016/j.bmcl.2009.09.080
BindingDB Entry DOI: 10.7270/Q24B31G4
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK3


(Homo sapiens (Human))
BDBM50311647
PNG
((+/-)-2-(1H-benzo[d]imidazol-1-yl)-9-(5-fluorochro...)
Show SMILES Fc1cccc2OCCC(c12)n1c2nc(ncc2[nH]c1=O)-n1cnc2ccccc12
Show InChI InChI=1S/C21H15FN6O2/c22-12-4-3-7-17-18(12)16(8-9-30-17)28-19-14(25-21(28)29)10-23-20(26-19)27-11-24-13-5-1-2-6-15(13)27/h1-7,10-11,16H,8-9H2,(H,25,29)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

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

Patents


Similars

Article
PubMed
n/an/a 48n/an/an/an/an/an/a



Ligand Pharmaceuticals, Inc

Curated by ChEMBL


Assay Description
Inhibition of human JAK3 (508-1124) by time resolved fluorescence assay


Bioorg Med Chem Lett 19: 6788-92 (2009)


Article DOI: 10.1016/j.bmcl.2009.09.080
BindingDB Entry DOI: 10.7270/Q24B31G4
More data for this
Ligand-Target Pair