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BDBM146968 US8957074, 7

SMILES: CN(C)C(=O)c1cc2cnc(Nc3ccc(cn3)C(=O)N3CC4CCC3C4O)nc2n1C1CCCCCC1

InChI Key: InChIKey=KDYZIBQFKOKQRM-UHFFFAOYNA-N

Data: 2 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 146968   
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))
BDBM146968
PNG
(US8957074, 7)
Show SMILES CN(C)C(=O)c1cc2cnc(Nc3ccc(cn3)C(=O)N3CC4CCC3C4O)nc2n1C1CCCCCC1
Show InChI InChI=1/C28H35N7O3/c1-33(2)27(38)22-13-19-15-30-28(32-25(19)35(22)20-7-5-3-4-6-8-20)31-23-12-10-17(14-29-23)26(37)34-16-18-9-11-21(34)24(18)36/h10,12-15,18,20-21,24,36H,3-9,11,16H2,1-2H3,(H,29,30,31,32)
PDB

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UniProtKB/SwissProt

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GoogleScholar
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 1.76E+4n/an/an/an/an/a25



Novartis AG

US Patent


Assay Description
A 384-well microtiter IMAP-FP (Molecular Devices Trade Mark Technology) endpoint assay was used for CDK1/cyclin B kinase activity measurements. The s...


US Patent US8957074 (2015)


BindingDB Entry DOI: 10.7270/Q2K0730S
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 4


(Homo sapiens (Human))
BDBM146968
PNG
(US8957074, 7)
Show SMILES CN(C)C(=O)c1cc2cnc(Nc3ccc(cn3)C(=O)N3CC4CCC3C4O)nc2n1C1CCCCCC1
Show InChI InChI=1/C28H35N7O3/c1-33(2)27(38)22-13-19-15-30-28(32-25(19)35(22)20-7-5-3-4-6-8-20)31-23-12-10-17(14-29-23)26(37)34-16-18-9-11-21(34)24(18)36/h10,12-15,18,20-21,24,36H,3-9,11,16H2,1-2H3,(H,29,30,31,32)
PDB
MMDB

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KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
GoogleScholar
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 21n/an/an/an/a7.522



Novartis AG

US Patent


Assay Description
An assay for monitoring CDK4/cyclin D1-catalyzed phosphorylation of pRb at the Ser780 site was performed using TR-FRET in a 384-well format, and was ...


US Patent US8957074 (2015)


BindingDB Entry DOI: 10.7270/Q2K0730S
More data for this
Ligand-Target Pair