BindingDB logo
myBDB logout

BDBM50195392 CHEMBL220370::N-(4-(1H-pyrrol-1-yl)benzyl)-N-(2-(dibutylamino)ethyl)-4-pentylbenzamide

SMILES: CCCCCc1ccc(cc1)C(=O)N(CCN(CCCC)CCCC)Cc1ccc(cc1)-n1cccc1

InChI Key: InChIKey=PKAFZIXYLJTMNU-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 = 50195392   
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
Plasmepsin 2


(Plasmodium falciparum)
BDBM50195392
PNG
(CHEMBL220370 | N-(4-(1H-pyrrol-1-yl)benzyl)-N-(2-(...)
Show SMILES CCCCCc1ccc(cc1)C(=O)N(CCN(CCCC)CCCC)Cc1ccc(cc1)-n1cccc1
Show InChI InChI=1S/C33H47N3O/c1-4-7-10-13-29-14-18-31(19-15-29)33(37)36(27-26-34(22-8-5-2)23-9-6-3)28-30-16-20-32(21-17-30)35-24-11-12-25-35/h11-12,14-21,24-25H,4-10,13,22-23,26-28H2,1-3H3
PDB
MMDB

KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

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

Similars

Article
PubMed
n/an/a 240n/an/an/an/an/an/a



Actelion Pharmaceuticals Ltd

Curated by ChEMBL


Assay Description
Inhibition of PM2 by FRET assay


Bioorg Med Chem Lett 16: 6194-9 (2006)


Article DOI: 10.1016/j.bmcl.2006.09.027
BindingDB Entry DOI: 10.7270/Q2QJ7GZN
More data for this
Ligand-Target Pair