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BDBM50363210 CHEMBL1947161

SMILES: C1C\C=C\CNc2cccc(Nc3nccc(n3)-c3cccc(O1)c3)c2

InChI Key: InChIKey=USIDNFXDNPBRBR-OWOJBTEDSA-N

Data: 3 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50363210   
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))
BDBM50363210
PNG
(CHEMBL1947161)
Show SMILES C1C\C=C\CNc2cccc(Nc3nccc(n3)-c3cccc(O1)c3)c2
Show InChI InChI=1S/C21H20N4O/c1-2-11-22-17-7-5-8-18(15-17)24-21-23-12-10-20(25-21)16-6-4-9-19(14-16)26-13-3-1/h1-2,4-10,12,14-15,22H,3,11,13H2,(H,23,24,25)/b2-1+
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PubMed
n/an/a 3.30E+3n/an/an/an/an/an/a



S BIO Pte. Ltd.

Curated by ChEMBL


Assay Description
Inhibition of recombinant JAK2 using poly(Glu,Ala,Tyr) as substrate after 2 hrs by luminescence assay


J Med Chem 55: 169-96 (2012)

Checked by Author
Article DOI: 10.1021/jm201112g
BindingDB Entry DOI: 10.7270/Q2M61KPN
More data for this
Ligand-Target Pair
Tyrosine-protein kinase receptor FLT3


(Homo sapiens (Human))
BDBM50363210
PNG
(CHEMBL1947161)
Show SMILES C1C\C=C\CNc2cccc(Nc3nccc(n3)-c3cccc(O1)c3)c2
Show InChI InChI=1S/C21H20N4O/c1-2-11-22-17-7-5-8-18(15-17)24-21-23-12-10-20(25-21)16-6-4-9-19(14-16)26-13-3-1/h1-2,4-10,12,14-15,22H,3,11,13H2,(H,23,24,25)/b2-1+
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UniProtKB/SwissProt

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DrugBank
GoogleScholar
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PC cid
PC sid
UniChem

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Article
PubMed
n/an/a 2.90E+3n/an/an/an/an/an/a



S BIO Pte. Ltd.

Curated by ChEMBL


Assay Description
Inhibition of recombinant Flt3 using poly(Glu,Tyr) as substrate after 2 hrs by luminescence assay


J Med Chem 55: 169-96 (2012)

Checked by Author
Article DOI: 10.1021/jm201112g
BindingDB Entry DOI: 10.7270/Q2M61KPN
More data for this
Ligand-Target Pair
Cyclin-Dependent Kinase 2 (CDK2)


(Homo sapiens (Human))
BDBM50363210
PNG
(CHEMBL1947161)
Show SMILES C1C\C=C\CNc2cccc(Nc3nccc(n3)-c3cccc(O1)c3)c2
Show InChI InChI=1S/C21H20N4O/c1-2-11-22-17-7-5-8-18(15-17)24-21-23-12-10-20(25-21)16-6-4-9-19(14-16)26-13-3-1/h1-2,4-10,12,14-15,22H,3,11,13H2,(H,23,24,25)/b2-1+
PDB
MMDB

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KEGG

UniProtKB/SwissProt

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DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Patents

Article
PubMed
n/an/a 150n/an/an/an/an/an/a



S BIO Pte. Ltd.

Curated by ChEMBL


Assay Description
Inhibition of recombinant Cdk2/cyclin A using RbING as substrate after 2 hrs by luminescence assay


J Med Chem 55: 169-96 (2012)

Checked by Author
Article DOI: 10.1021/jm201112g
BindingDB Entry DOI: 10.7270/Q2M61KPN
More data for this
Ligand-Target Pair