BindingDB

null

SMILES Brc1ccc2C(C(=O)Nc2c1)c1[nH]c2ccccc2c1N=O

InChI Key InChIKey=OLOJSTRISMGUEK-UHFFFAOYSA-N

PDB links: 1 PDB ID matches this monomer. 2 PDB IDs contain inhibitors having a similarity of 90% to this monomer.

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 7401

Cyclin-dependent kinase 1/G2/mitotic-specific cyclin-B1/G2/mitotic-specific cyclin-B2/G2/mitotic-specific cyclin-B3(Homo sapiens (Human))
The Rockefeller University

Curated by ChEMBL

BDBM7401((2 Z,3 E)-6-Bromoindirubin-3 -oxime | (3E)-6-bromo...)copy SMILEScopy InChI

IC50: 320nMAssay Description:Inhibition of CDK1/cyclinBMore data for this Ligand-Target Pair

PDB
UniProtKB/SwissProt
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CHEMBL MMDB PC cid PC sid PDB Patents Similars

Details Article
BindingDB Entry DOI: 10.7270/Q2VX0HG5PubMed

Targets 20 ▿
- Cyclin-dependent kinase 1 2
- Dual specificity tyrosine-phosphorylation-regulated kinase 1A 2
- Cyclin-dependent kinase 5 2
- Cyclin-dependent kinase 5 activator 1 2
- Glycogen synthase kinase-3 beta 2
- Cyclin-dependent kinase 5 activator 1 [99-307] 1
- 3-phosphoinositide-dependent protein kinase 1 1
- Beta-galactosidase 1
- Cyclin-dependent kinase 1/G2/mitotic-specific cyclin-B 1
- Dual specificity protein kinase CLK1 1
- Casein kinase I isoform alpha 1
- Caspase-3 1
- Interferon-induced, double-stranded RNA-activated protein kinase 1
- Sentrin-specific protease 8 1
- Cyclin-dependent kinase 1/G2/mitotic-specific cyclin-B1/G2/mitotic-specific cyclin-B2/G2/mitotic-specific cyclin-B3 1
- Sentrin-specific protease 6 1
- Streptokinase A 1
- C-C chemokine receptor type 6 1
- Glycogen synthase kinase-3 alpha 1
- Dual specificity tyrosine-phosphorylation-regulated kinase 2 1
Publications 16 ▿
- ACS Med Chem Lett 4: 22-26 (2013) 5
- J Med Chem 47: 935-46 (2004) 3
- Bioorg Med Chem 22: 1909-15 (2014) 3
- J Nat Prod 72: 2199-202 (2009) 2
- Bioorg Med Chem Lett 21: 4108-14 (2011) 1
- PubChem Bioassay (2010) 1
- PubChem Bioassay (2011) 1
- J Med Chem 51: 6421-31 (2008) 1
- Proc Natl Acad Sci USA 104: 20523-8 (2007) 1
- PubChem Bioassay (2010) 1
- PubChem Bioassay (2009) 1
- PubChem Bioassay (2011) 1
- Trends Pharmacol Sci 25: 471-80 (2004) 1
- Chem Biol 14: 1207-14 (2007) 1
- PubChem Bioassay (2010) 1
- J Med Chem 49: 4638-49 (2006) 1
Institutions 9 ▿
- [University of Athens] 11
- [Burnham Center for Chemical Genomics] 5
- [Rajiv Gandhi Proudyogiki Vishwavidyalaya] 3
- [University of Munich, C.N.R.S., Weill Cornell Medical College, University of Oxford, The Rockefeller University, Broad Institute] 1
- [University of Munich, C.N.R.S., Weill Cornell Medical College, University of Oxford, The Rockefeller University, Broad Institute] 1
- [University of Munich, C.N.R.S., Weill Cornell Medical College, University of Oxford, The Rockefeller University, Broad Institute] 1
- [University of Munich, C.N.R.S., Weill Cornell Medical College, University of Oxford, The Rockefeller University, Broad Institute] 1
- [University of Munich, C.N.R.S., Weill Cornell Medical College, University of Oxford, The Rockefeller University, Broad Institute] 1
- [University of Munich, C.N.R.S., Weill Cornell Medical College, University of Oxford, The Rockefeller University, Broad Institute] 1
Affinity: 5 to 1.0E+5 nM▿
- IC50 24
- EC50 1
- Affinity ≤ nM
Xtal structures: 1
Docked structures: 0
Catalog Cmpds: 0