BindingDB logo
myBDB logout

PubMed code 12408708

Compile data set for download or QSAR
Found 7 hits of Enzyme Inhibition Constant Data   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Histidine-rich protein PFHRP-II


(Plasmodium falciparum)
BDBM22985
PNG
(Aralen | CHEMBL76 | CHLOROQUINE PHOSPHATE | Chloro...)
Show SMILES CCN(CC)CCCC(C)Nc1ccnc2cc(Cl)ccc12
Show InChI InChI=1S/C18H26ClN3/c1-4-22(5-2)12-6-7-14(3)21-17-10-11-20-18-13-15(19)8-9-16(17)18/h8-11,13-14H,4-7,12H2,1-3H3,(H,20,21)
UniProtKB/SwissProt

GoogleScholar
AffyNet 
Purchase

CHEMBL
DrugBank
MCE
KEGG
PC cid
PC sid
PDB
UniChem

Patents


Similars

PubMed
n/an/a 3.80E+4n/an/an/an/an/an/a



The University of Liverpool

Curated by ChEMBL


Assay Description
Inhibition of beta-hematin formation


J Med Chem 45: 4975-83 (2002)


BindingDB Entry DOI: 10.7270/Q2P55PQ4
More data for this
Ligand-Target Pair
Histidine-rich protein PFHRP-II


(Plasmodium falciparum)
BDBM50120736
PNG
((2-Piperidin-1-yl-ethyl)-(7-trifluoromethyl-quinol...)
Show SMILES FC(F)(F)c1ccc2c(NCCN3CCCCC3)ccnc2c1
Show InChI InChI=1S/C17H20F3N3/c18-17(19,20)13-4-5-14-15(6-7-21-16(14)12-13)22-8-11-23-9-2-1-3-10-23/h4-7,12H,1-3,8-11H2,(H,21,22)
UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/a 6.50E+4n/an/an/an/an/an/a



The University of Liverpool

Curated by ChEMBL


Assay Description
Inhibition of beta-hematin formation


J Med Chem 45: 4975-83 (2002)


BindingDB Entry DOI: 10.7270/Q2P55PQ4
More data for this
Ligand-Target Pair
Histidine-rich protein PFHRP-II


(Plasmodium falciparum)
BDBM50120735
PNG
(CHEMBL146617 | N-(7-chloroquinolin-4-yl)-N-tert-bu...)
Show SMILES CC(C)(C)NCCNc1ccnc2cc(Cl)ccc12
Show InChI InChI=1S/C15H20ClN3/c1-15(2,3)19-9-8-18-13-6-7-17-14-10-11(16)4-5-12(13)14/h4-7,10,19H,8-9H2,1-3H3,(H,17,18)
UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/a 7.00E+4n/an/an/an/an/an/a



The University of Liverpool

Curated by ChEMBL


Assay Description
Inhibition of beta-hematin formation


J Med Chem 45: 4975-83 (2002)


BindingDB Entry DOI: 10.7270/Q2P55PQ4
More data for this
Ligand-Target Pair
Histidine-rich protein PFHRP-II


(Plasmodium falciparum)
BDBM50120737
PNG
(CHEMBL148195 | N-tert-Butyl-N'-(7-trifluoromethyl-...)
Show SMILES CC(C)(C)NCCNc1ccnc2cc(ccc12)C(F)(F)F
Show InChI InChI=1S/C16H20F3N3/c1-15(2,3)22-9-8-21-13-6-7-20-14-10-11(16(17,18)19)4-5-12(13)14/h4-7,10,22H,8-9H2,1-3H3,(H,20,21)
UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/a 7.10E+4n/an/an/an/an/an/a



The University of Liverpool

Curated by ChEMBL


Assay Description
Inhibition of beta-hematin formation


J Med Chem 45: 4975-83 (2002)


BindingDB Entry DOI: 10.7270/Q2P55PQ4
More data for this
Ligand-Target Pair
Histidine-rich protein PFHRP-II


(Plasmodium falciparum)
BDBM50120738
PNG
((7-Chloro-quinolin-4-yl)-(2-pyrrolidin-1-yl-ethyl)...)
Show SMILES Clc1ccc2c(NCCN3CCCC3)ccnc2c1
Show InChI InChI=1S/C15H18ClN3/c16-12-3-4-13-14(5-6-17-15(13)11-12)18-7-10-19-8-1-2-9-19/h3-6,11H,1-2,7-10H2,(H,17,18)
UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

PubMed
n/an/a 7.80E+4n/an/an/an/an/an/a



The University of Liverpool

Curated by ChEMBL


Assay Description
Inhibition of beta-hematin formation


J Med Chem 45: 4975-83 (2002)


BindingDB Entry DOI: 10.7270/Q2P55PQ4
More data for this
Ligand-Target Pair
Histidine-rich protein PFHRP-II


(Plasmodium falciparum)
BDBM50120734
PNG
((7-Chloro-quinolin-4-yl)-(2-piperidin-1-yl-ethyl)-...)
Show SMILES Clc1ccc2c(NCCN3CCCCC3)ccnc2c1
Show InChI InChI=1S/C16H20ClN3/c17-13-4-5-14-15(6-7-18-16(14)12-13)19-8-11-20-9-2-1-3-10-20/h4-7,12H,1-3,8-11H2,(H,18,19)
UniProtKB/SwissProt

GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

PubMed
n/an/a 8.60E+4n/an/an/an/an/an/a



The University of Liverpool

Curated by ChEMBL


Assay Description
Inhibition of beta-hematin formation


J Med Chem 45: 4975-83 (2002)


BindingDB Entry DOI: 10.7270/Q2P55PQ4
More data for this
Ligand-Target Pair
Histidine-rich protein PFHRP-II


(Plasmodium falciparum)
BDBM50120739
PNG
((7-Chloro-quinolin-4-yl)-(2-morpholin-4-yl-ethyl)-...)
Show SMILES Clc1ccc2c(NCCN3CCOCC3)ccnc2c1
Show InChI InChI=1S/C15H18ClN3O/c16-12-1-2-13-14(3-4-17-15(13)11-12)18-5-6-19-7-9-20-10-8-19/h1-4,11H,5-10H2,(H,17,18)
UniProtKB/SwissProt

GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/a 1.02E+5n/an/an/an/an/an/a



The University of Liverpool

Curated by ChEMBL


Assay Description
Inhibition of beta-hematin formation


J Med Chem 45: 4975-83 (2002)


BindingDB Entry DOI: 10.7270/Q2P55PQ4
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%