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Compile Data Set for Download or QSAR

Found 2 hits of kd for UniProtKB: P06493   
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 1


(Homo sapiens (Human))
BDBM154576
PNG
(K03861 (1))
Show SMILES CN1CCN(Cc2ccc(NC(=O)Nc3ccc(Oc4ccnc(N)n4)cc3)cc2C(F)(F)F)CC1
Show InChI InChI=1S/C24H26F3N7O2/c1-33-10-12-34(13-11-33)15-16-2-3-18(14-20(16)24(25,26)27)31-23(35)30-17-4-6-19(7-5-17)36-21-8-9-29-22(28)32-21/h2-9,14H,10-13,15H2,1H3,(H2,28,29,32)(H2,30,31,35)
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MCE
PC cid
PC sid
PDB
UniChem

Similars

Article
PubMed
n/an/an/a 53n/an/an/an/an/a



The First Affiliated Hospital of Zhengzhou University

Curated by ChEMBL


Assay Description
Binding affinity to CDK1 (unknown origin)


Eur J Med Chem 164: 615-639 (2019)


Article DOI: 10.1016/j.ejmech.2019.01.003
BindingDB Entry DOI: 10.7270/Q2C53QDZ
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 1


(Homo sapiens (Human))
BDBM50519158
PNG
(CHEMBL4445812)
Show SMILES Clc1ccc(cc1Cl)C(=O)Nc1ccc2cc(ccc2c1)C(=O)Nc1nccs1
Show InChI InChI=1S/C21H13Cl2N3O2S/c22-17-6-4-15(11-18(17)23)19(27)25-16-5-3-12-9-14(2-1-13(12)10-16)20(28)26-21-24-7-8-29-21/h1-11H,(H,25,27)(H,24,26,28)
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PC cid
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UniChem
Article
PubMed
n/an/an/a 8.02E+3n/an/an/an/an/a



Chengdu University

Curated by ChEMBL


Assay Description
Binding affinity to wild-type human full-length CDK1 (M1 to M297 residues) expressed in mammalian expression system measured after 1 hr by kinomescan...


J Med Chem 62: 7697-7707 (2019)


Article DOI: 10.1021/acs.jmedchem.9b00353
BindingDB Entry DOI: 10.7270/Q2X06BF7
More data for this
Ligand-Target Pair