BindingDB logo
myBDB logout

BDBM307893 N-{5-chloro-4-[1-(3-fluorobenzyl)-1H-benzimidazol-6-yl]pyridin-2-yl}-3-oxocyclobutanecarboxamide::US9650358, Example 189

SMILES: Fc1cccc(Cn2cnc3ccc(cc23)-c2cc(NC(=O)C3CC(=O)C3)ncc2Cl)c1

InChI Key: InChIKey=HEVFRDDWFUPZRH-UHFFFAOYSA-N

Data: 1 IC50

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 = 307893   
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 9


(Homo sapiens (Human))
BDBM307893
PNG
(N-{5-chloro-4-[1-(3-fluorobenzyl)-1H-benzimidazol-...)
Show SMILES Fc1cccc(Cn2cnc3ccc(cc23)-c2cc(NC(=O)C3CC(=O)C3)ncc2Cl)c1
Show InChI InChI=1S/C24H18ClFN4O2/c25-20-11-27-23(29-24(32)16-7-18(31)8-16)10-19(20)15-4-5-21-22(9-15)30(13-28-21)12-14-2-1-3-17(26)6-14/h1-6,9-11,13,16H,7-8,12H2,(H,27,29,32)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 27n/an/an/an/an/an/a



AbbVie Inc.

US Patent


Assay Description
CDK9 enzyme activities were measured using LANCE ULight TR-FRET kinase assay reagents (PerkinElmer, Waltham, Mass.). Compounds were directly added in...


US Patent US9650358 (2017)


BindingDB Entry DOI: 10.7270/Q2057J0M
More data for this
Ligand-Target Pair