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BDBM50123574 CHEMBL346177::[3-(4-{3-[Bis-(4-phenoxy-benzyl)-amino]-propyl}-piperazin-1-yl)-propyl]-(7-chloro-quinolin-4-yl)-amine

SMILES: Clc1ccc2c(NCCCN3CCN(CCCN(Cc4ccc(Oc5ccccc5)cc4)Cc4ccc(Oc5ccccc5)cc4)CC3)ccnc2c1

InChI Key: InChIKey=MTECXWVPBDBRLY-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50123574   
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
Histidine-rich protein


(Plasmodium falciparum)		BDBM50123574
PNG
(CHEMBL346177 | [3-(4-{3-[Bis-(4-phenoxy-benzyl)-am...)
Show SMILES Clc1ccc2c(NCCCN3CCN(CCCN(Cc4ccc(Oc5ccccc5)cc4)Cc4ccc(Oc5ccccc5)cc4)CC3)ccnc2c1
Show InChI InChI=1S/C45H48ClN5O2/c46-38-17-22-43-44(23-25-48-45(43)33-38)47-24-7-26-49-29-31-50(32-30-49)27-8-28-51(34-36-13-18-41(19-14-36)52-39-9-3-1-4-10-39)35-37-15-20-42(21-16-37)53-40-11-5-2-6-12-40/h1-6,9-23,25,33H,7-8,24,26-32,34-35H2,(H,47,48)
UniProtKB/SwissProt

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PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/a 74.9n/an/an/an/an/an/a



Universit£ de Lille II

Curated by ChEMBL


Assay Description
In vitro inhibition of beta-hematin formation

J Med Chem 46: 542-57 (2003)


Article DOI: 10.1021/jm020960r
BindingDB Entry DOI: 10.7270/Q27W6DDC
More data for this
Ligand-Target Pair