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BDBM50343423 1-[2-Chloro-2-(4-fluorophenyl)ethyl]-N-(pyridin-2-ylmethyl)-1Hpyrazolo[3,4-d]pyrimidin-4-amine::CHEMBL1773092

SMILES: Fc1ccc(cc1)C(Cl)Cn1ncc2c(NCc3ccccn3)ncnc12

InChI Key: InChIKey=DRIJFUAWMVHGOZ-UHFFFAOYSA-N

Data: 2 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50343423   
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 ABL1


(Homo sapiens (Human))
BDBM50343423
PNG
(1-[2-Chloro-2-(4-fluorophenyl)ethyl]-N-(pyridin-2-...)
Show SMILES Fc1ccc(cc1)C(Cl)Cn1ncc2c(NCc3ccccn3)ncnc12
Show InChI InChI=1S/C19H16ClFN6/c20-17(13-4-6-14(21)7-5-13)11-27-19-16(10-26-27)18(24-12-25-19)23-9-15-3-1-2-8-22-15/h1-8,10,12,17H,9,11H2,(H,23,24,25)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

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

Similars

Article
PubMed
2.10E+3n/an/an/an/an/an/an/an/a



University of Siena

Curated by ChEMBL


Assay Description
Inhibition of human recombinant c-Abl by filter-binding assay


J Med Chem 54: 2610-26 (2011)


Article DOI: 10.1021/jm1012819
BindingDB Entry DOI: 10.7270/Q28K79F5
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))
BDBM50343423
PNG
(1-[2-Chloro-2-(4-fluorophenyl)ethyl]-N-(pyridin-2-...)
Show SMILES Fc1ccc(cc1)C(Cl)Cn1ncc2c(NCc3ccccn3)ncnc12
Show InChI InChI=1S/C19H16ClFN6/c20-17(13-4-6-14(21)7-5-13)11-27-19-16(10-26-27)18(24-12-25-19)23-9-15-3-1-2-8-22-15/h1-8,10,12,17H,9,11H2,(H,23,24,25)
PDB
MMDB

KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
8.30E+3n/an/an/an/an/an/an/an/a



University of Siena

Curated by ChEMBL


Assay Description
Inhibition of human recombinant c-Src by filter-binding assay


J Med Chem 54: 2610-26 (2011)


Article DOI: 10.1021/jm1012819
BindingDB Entry DOI: 10.7270/Q28K79F5
More data for this
Ligand-Target Pair