BindingDB logo
myBDB logout

null

SMILES: Cc1noc(NS(=O)(=O)c2ccc(Nc3nccc(n3)-c3ccc(Cl)cc3Cl)cc2)c1C

InChI Key: InChIKey=LVQNVBAEMYBEOA-UHFFFAOYSA-N

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50454443   
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-T1/Cyclin-dependent kinase 9


(Homo sapiens (Human))		BDBM50454443
PNG
(CHEMBL4204120)
Show SMILES Cc1noc(NS(=O)(=O)c2ccc(Nc3nccc(n3)-c3ccc(Cl)cc3Cl)cc2)c1C
Show InChI InChI=1S/C21H17Cl2N5O3S/c1-12-13(2)27-31-20(12)28-32(29,30)16-6-4-15(5-7-16)25-21-24-10-9-19(26-21)17-8-3-14(22)11-18(17)23/h3-11,28H,1-2H3,(H,24,25,26)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 50n/an/an/an/an/an/a



Semmelweis University

Curated by ChEMBL


Assay Description
Inhibition of N-terminal GST-HIS6 fusion protein tagged human full length CDK9 (M1 to F372 residues)/N-terminal GST-HIS6 fusion protein tagged human ...

Bioorg Med Chem Lett 28: 769-773 (2018)


Article DOI: 10.1016/j.bmcl.2018.01.002
BindingDB Entry DOI: 10.7270/Q20867XN
More data for this
Ligand-Target Pair