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Compile Data Set for Download or QSAR

Found 5 hits Enz. Inhib. hit(s) with Target = 'Cyclin-dependent kinase 4' and Ligand = 'BDBM59087'   
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-dependent kinase 4


(Homo sapiens (Human))
BDBM59087
PNG
(CHEMBL258765 | Fasca-plysi | Fascaplysin)
Show SMILES O=C1c2ccccc2-[n+]2ccc3c([nH]c4ccccc34)c12
Show InChI InChI=1S/C18H10N2O/c21-18-13-6-2-4-8-15(13)20-10-9-12-11-5-1-3-7-14(11)19-16(12)17(18)20/h1-10H/p+1
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MCE
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Article
PubMed
n/an/a 350n/an/an/an/an/an/a



Cyclacel Limited



Assay Description
In vitro kinase inhibition assay.


Chem Biol 11: 525-34 (2004)


Article DOI: 10.1016/j.chembiol.2004.03.022
BindingDB Entry DOI: 10.7270/Q2Q23XP3
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 4


(Homo sapiens (Human))
BDBM59087
PNG
(CHEMBL258765 | Fasca-plysi | Fascaplysin)
Show SMILES O=C1c2ccccc2-[n+]2ccc3c([nH]c4ccccc34)c12
Show InChI InChI=1S/C18H10N2O/c21-18-13-6-2-4-8-15(13)20-10-9-12-11-5-1-3-7-14(11)19-16(12)17(18)20/h1-10H/p+1
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Article
PubMed
n/an/a 350n/an/an/an/an/an/a



Griffith University

Curated by ChEMBL


Assay Description
Inhibition of CDK4


J Nat Prod 69: 14-7 (2006)


Article DOI: 10.1021/np050229y
BindingDB Entry DOI: 10.7270/Q2FJ2GHF
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 4


(Homo sapiens (Human))
BDBM59087
PNG
(CHEMBL258765 | Fasca-plysi | Fascaplysin)
Show SMILES O=C1c2ccccc2-[n+]2ccc3c([nH]c4ccccc34)c12
Show InChI InChI=1S/C18H10N2O/c21-18-13-6-2-4-8-15(13)20-10-9-12-11-5-1-3-7-14(11)19-16(12)17(18)20/h1-10H/p+1
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Article
PubMed
n/an/a 350n/an/an/an/an/an/a



CSIR-Indian Institute of Integrative Medicine

Curated by ChEMBL


Assay Description
Inhibition of CDK4 (unknown origin)


Eur J Med Chem 107: 1-11 (2016)


Article DOI: 10.1016/j.ejmech.2015.10.049
BindingDB Entry DOI: 10.7270/Q2H70JSM
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 4


(Homo sapiens (Human))
BDBM59087
PNG
(CHEMBL258765 | Fasca-plysi | Fascaplysin)
Show SMILES O=C1c2ccccc2-[n+]2ccc3c([nH]c4ccccc34)c12
Show InChI InChI=1S/C18H10N2O/c21-18-13-6-2-4-8-15(13)20-10-9-12-11-5-1-3-7-14(11)19-16(12)17(18)20/h1-10H/p+1
PDB
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CHEMBL
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PubMed
n/an/a 550n/an/an/an/an/an/a



University of Leicester

Curated by ChEMBL


Assay Description
Inhibition of human CDK4/ Cyclin D1 catalytic subunit expressed in Sf9 insect cells assessed as GST-RB152 fusion protein phosphorylation-associated d...


Bioorg Med Chem 17: 6073-84 (2009)


Article DOI: 10.1016/j.bmc.2009.06.070
BindingDB Entry DOI: 10.7270/Q27P8ZDP
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 4


(Homo sapiens (Human))
BDBM59087
PNG
(CHEMBL258765 | Fasca-plysi | Fascaplysin)
Show SMILES O=C1c2ccccc2-[n+]2ccc3c([nH]c4ccccc34)c12
Show InChI InChI=1S/C18H10N2O/c21-18-13-6-2-4-8-15(13)20-10-9-12-11-5-1-3-7-14(11)19-16(12)17(18)20/h1-10H/p+1
PDB
MMDB

NCI pathway
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KEGG

UniProtKB/SwissProt

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CHEMBL
MCE
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 550n/an/an/an/an/an/a



University of Leicester

Curated by ChEMBL


Assay Description
Inhibition of human CDK4/GST-cyclin D1 expressed in Sf9 cells assessed as retinoblastoma GST-RB152 phosphorylation


Bioorg Med Chem 16: 7728-39 (2008)


Article DOI: 10.1016/j.bmc.2008.07.002
BindingDB Entry DOI: 10.7270/Q2348K57
More data for this
Ligand-Target Pair