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BDBM50352814 CHEMBL1823654

SMILES: Clc1ccc(cc1Cl)C(NC(=O)c1ccc2cnccc2c1)C1CCNC1

InChI Key: InChIKey=REUCABNHPPJJRD-UHFFFAOYSA-N

Data: 2 IC50

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 2 hits for monomerid = 50352814   
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
Cyclin-dependent kinase 2


(Homo sapiens (Human))
BDBM50352814
PNG
(CHEMBL1823654)
Show SMILES Clc1ccc(cc1Cl)C(NC(=O)c1ccc2cnccc2c1)C1CCNC1
Show InChI InChI=1S/C21H19Cl2N3O/c22-18-4-3-14(10-19(18)23)20(17-6-8-25-12-17)26-21(27)15-1-2-16-11-24-7-5-13(16)9-15/h1-5,7,9-11,17,20,25H,6,8,12H2,(H,26,27)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

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

Similars

Article
PubMed
n/an/a>2.50E+4n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Inhibition of CDK2


Bioorg Med Chem Lett 21: 5191-6 (2011)


Article DOI: 10.1016/j.bmcl.2011.07.056
BindingDB Entry DOI: 10.7270/Q21G0MNQ
More data for this
Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase


(Homo sapiens (Human))
BDBM50352814
PNG
(CHEMBL1823654)
Show SMILES Clc1ccc(cc1Cl)C(NC(=O)c1ccc2cnccc2c1)C1CCNC1
Show InChI InChI=1S/C21H19Cl2N3O/c22-18-4-3-14(10-19(18)23)20(17-6-8-25-12-17)26-21(27)15-1-2-16-11-24-7-5-13(16)9-15/h1-5,7,9-11,17,20,25H,6,8,12H2,(H,26,27)
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 30n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Inhibition of AKT1


Bioorg Med Chem Lett 21: 5191-6 (2011)


Article DOI: 10.1016/j.bmcl.2011.07.056
BindingDB Entry DOI: 10.7270/Q21G0MNQ
More data for this
Ligand-Target Pair