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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Cyclin-K/Cyclin-dependent kinase 12' and Ligand = 'BDBM479015'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Cyclin-K/Cyclin-dependent kinase 12


(Homo sapiens (Human))
BDBM479015
PNG
((R)-N-(4-(3-((5-chloro-4- methylpyridin-2- yl)amin...)
Show SMILES Cc1cc(N[C@@H]2CCN(C2)C(=O)c2ccc(NC(=O)C=C)cc2)ncc1Cl |r|
Show InChI InChI=1S/C20H21ClN4O2/c1-3-19(26)24-15-6-4-14(5-7-15)20(27)25-9-8-16(12-25)23-18-10-13(2)17(21)11-22-18/h3-7,10-11,16H,1,8-9,12H2,2H3,(H,22,23)(H,24,26)/t16-/m1/s1
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a<100n/an/an/an/an/an/a


TBA

Assay Description
The IC50 profile of compounds was determined using one protein kinase in a customized, thiol free assay. IC50 values were measured by testing 10 conc...


Citation and Details

BindingDB Entry DOI: 10.7270/Q2R78JFB
More data for this
Ligand-Target Pair
Cyclin-K/Cyclin-dependent kinase 12


(Homo sapiens (Human))
BDBM479015
PNG
((R)-N-(4-(3-((5-chloro-4- methylpyridin-2- yl)amin...)
Show SMILES Cc1cc(N[C@@H]2CCN(C2)C(=O)c2ccc(NC(=O)C=C)cc2)ncc1Cl |r|
Show InChI InChI=1S/C20H21ClN4O2/c1-3-19(26)24-15-6-4-14(5-7-15)20(27)25-9-8-16(12-25)23-18-10-13(2)17(21)11-22-18/h3-7,10-11,16H,1,8-9,12H2,2H3,(H,22,23)(H,24,26)/t16-/m1/s1
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 550n/an/an/an/an/an/a


TBA

Assay Description
The IC50 profile of test compounds was determined using three protein kinases. IC50 values were measured by testing 10 concentrations (1×10−04M...


Citation and Details

BindingDB Entry DOI: 10.7270/Q2R78JFB
More data for this
Ligand-Target Pair