BindingDB logo
myBDB logout

BDBM50424741 CHEMBL2314183

SMILES: Cc1cc(OCCCn2c(cc3ccccc23)C(O)=O)cc(C)c1Cl

InChI Key: InChIKey=PDMKFDARJPXMCS-UHFFFAOYSA-N

Data: 1 KI

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 = 50424741   
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
Induced myeloid leukemia cell differentiation protein Mcl-1


(Homo sapiens (Human))
BDBM50424741
PNG
(CHEMBL2314183)
Show SMILES Cc1cc(OCCCn2c(cc3ccccc23)C(O)=O)cc(C)c1Cl
Show InChI InChI=1S/C20H20ClNO3/c1-13-10-16(11-14(2)19(13)21)25-9-5-8-22-17-7-4-3-6-15(17)12-18(22)20(23)24/h3-4,6-7,10-12H,5,8-9H2,1-2H3,(H,23,24)
PDB
MMDB

NCI pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
410n/an/an/an/an/an/an/an/a



Vanderbilt University School of Medicine

Curated by ChEMBL


Assay Description
Displacement of FITC-AHx-KALETLRRVGDGVQRNHETAF-NH2 from human MCl1 (172 to 327) expressed in Escherichia coli BL21 (DE3) after 1 hr by fluorescence p...


J Med Chem 56: 15-30 (2013)


Article DOI: 10.1021/jm301448p
BindingDB Entry DOI: 10.7270/Q29G5P46
More data for this
Ligand-Target Pair