BindingDB logo
myBDB logout

PubMed code 25264478

Compile data set for download or QSAR
Found 6 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
Indoleamine 2,3-dioxygenase


(Homo sapiens (human))
BDBM50102739
PNG
(CHEMBL3335707)
Show SMILES CCc1cc(Nc2cnn[nH]2)ccc1Cl
Show InChI InChI=1S/C10H11ClN4/c1-2-7-5-8(3-4-9(7)11)13-10-6-12-15-14-10/h3-6H,2H2,1H3,(H2,12,13,14,15)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/a 100n/an/an/an/an/an/a



Therachem Research Medilab (India) Pvt. Ltd.

Curated by ChEMBL


Assay Description
Inhibition of intracellular IDO1 activity in human HeLa cells assessed as L-kynurenine production by Ehrlichs test


ACS Med Chem Lett 5: 958-60 (2014)


Article DOI: 10.1021/ml5002773
BindingDB Entry DOI: 10.7270/Q2J38VBG
More data for this
Ligand-Target Pair
Indoleamine 2,3-dioxygenase


(Homo sapiens (human))
BDBM50102740
PNG
(CHEMBL3335706)
Show SMILES CCc1cc(Cl)ccc1Nc1cnn[nH]1
Show InChI InChI=1S/C10H11ClN4/c1-2-7-5-8(11)3-4-9(7)13-10-6-12-15-14-10/h3-6H,2H2,1H3,(H2,12,13,14,15)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

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

Patents


Similars

Article
PubMed
n/an/a<100n/an/an/an/an/an/a



Therachem Research Medilab (India) Pvt. Ltd.

Curated by ChEMBL


Assay Description
Inhibition of intracellular IDO1 activity in human HeLa cells assessed as L-kynurenine production by Ehrlichs test


ACS Med Chem Lett 5: 958-60 (2014)


Article DOI: 10.1021/ml5002773
BindingDB Entry DOI: 10.7270/Q2J38VBG
More data for this
Ligand-Target Pair
Indoleamine 2,3-dioxygenase


(Homo sapiens (human))
BDBM50102732
PNG
(CHEMBL3335711)
Show SMILES Clc1ccc(Nc2cn[nH]n2)cc1C#N
Show InChI InChI=1S/C9H6ClN5/c10-8-2-1-7(3-6(8)4-11)13-9-5-12-15-14-9/h1-3,5H,(H2,12,13,14,15)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/a 100n/an/an/an/an/an/a



Therachem Research Medilab (India) Pvt. Ltd.

Curated by ChEMBL


Assay Description
Inhibition of intracellular IDO1 activity in human HeLa cells assessed as L-kynurenine production by Ehrlichs test


ACS Med Chem Lett 5: 958-60 (2014)


Article DOI: 10.1021/ml5002773
BindingDB Entry DOI: 10.7270/Q2J38VBG
More data for this
Ligand-Target Pair
Indoleamine 2,3-dioxygenase


(Homo sapiens (human))
BDBM50102733
PNG
(CHEMBL3335710)
Show SMILES Cc1cc(F)ccc1Nc1c[nH]nn1
Show InChI InChI=1S/C9H9FN4/c1-6-4-7(10)2-3-8(6)12-9-5-11-14-13-9/h2-5H,1H3,(H2,11,12,13,14)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/a<100n/an/an/an/an/an/a



Therachem Research Medilab (India) Pvt. Ltd.

Curated by ChEMBL


Assay Description
Inhibition of intracellular IDO1 activity in human HeLa cells assessed as L-kynurenine production by Ehrlichs test


ACS Med Chem Lett 5: 958-60 (2014)


Article DOI: 10.1021/ml5002773
BindingDB Entry DOI: 10.7270/Q2J38VBG
More data for this
Ligand-Target Pair
Indoleamine 2,3-dioxygenase


(Homo sapiens (human))
BDBM50102736
PNG
(CHEMBL3335708)
Show SMILES CS(=O)(=O)NCc1cc(Cl)ccc1Nc1cnn[nH]1
Show InChI InChI=1S/C10H12ClN5O2S/c1-19(17,18)13-5-7-4-8(11)2-3-9(7)14-10-6-12-16-15-10/h2-4,6,13H,5H2,1H3,(H2,12,14,15,16)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

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

Patents


Similars

Article
PubMed
n/an/a 1.00E+3n/an/an/an/an/an/a



Therachem Research Medilab (India) Pvt. Ltd.

Curated by ChEMBL


Assay Description
Inhibition of intracellular IDO1 activity in human HeLa cells assessed as L-kynurenine production by Ehrlichs test


ACS Med Chem Lett 5: 958-60 (2014)


Article DOI: 10.1021/ml5002773
BindingDB Entry DOI: 10.7270/Q2J38VBG
More data for this
Ligand-Target Pair
Indoleamine 2,3-dioxygenase


(Homo sapiens (human))
BDBM50102734
PNG
(CHEMBL3335709)
Show SMILES OC(=O)C1CC(Cc2cc(Cl)ccc2Nc2cn[nH]n2)C1
Show InChI InChI=1S/C14H15ClN4O2/c15-11-1-2-12(17-13-7-16-19-18-13)9(6-11)3-8-4-10(5-8)14(20)21/h1-2,6-8,10H,3-5H2,(H,20,21)(H2,16,17,18,19)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/a 1.00E+3n/an/an/an/an/an/a



Therachem Research Medilab (India) Pvt. Ltd.

Curated by ChEMBL


Assay Description
Inhibition of intracellular IDO1 activity in human HeLa cells assessed as L-kynurenine production by Ehrlichs test


ACS Med Chem Lett 5: 958-60 (2014)


Article DOI: 10.1021/ml5002773
BindingDB Entry DOI: 10.7270/Q2J38VBG
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%