BindingDB logo
myBDB logout

BDBM193179 US10526329, Compound 194::US9670204, 194 N-cyclopropyl-2-(4-(2-ethyl-3-((4-(4-fluorophenyl)thiazol-2-yl)(methyl)amino)imidazo[1,2-a]pyridin-6-yl)piperidin-1-yl)acetamide

SMILES: CCc1nc2ccc(cn2c1N(C)c1nc(cs1)-c1ccc(F)cc1)C1CCN(CC(=O)NC2CC2)CC1

InChI Key: InChIKey=GSHANZSQZQPMDO-UHFFFAOYSA-N

Data: 4 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 6 hits for monomerid = 193179   
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
Ectonucleotide pyrophosphatase/phosphodiesterase family member 2


(Homo sapiens (Human))
BDBM193179
PNG
(US10526329, Compound 194 | US11072611, Compound 19...)
Show SMILES CCc1nc2ccc(cn2c1N(C)c1nc(cs1)-c1ccc(F)cc1)C1CCN(CC(=O)NC2CC2)CC1
Show InChI InChI=1S/C29H33FN6OS/c1-3-24-28(34(2)29-33-25(18-38-29)20-4-7-22(30)8-5-20)36-16-21(6-11-26(36)32-24)19-12-14-35(15-13-19)17-27(37)31-23-9-10-23/h4-8,11,16,18-19,23H,3,9-10,12-15,17H2,1-2H3,(H,31,37)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a>1.00E+3n/an/an/an/a8.525



GALAPAGOS NV

US Patent


Assay Description
Compound IC50 values are determined in a hENPP2 (UniProtKB/SwissProt Sequence ref Q13822) biochemical assay using LPC as substrate. 5 μL of a di...


US Patent US9670204 (2017)


BindingDB Entry DOI: 10.7270/Q2W66HZS
More data for this
Ligand-Target Pair
Ectonucleotide pyrophosphatase/phosphodiesterase family member 2


(Homo sapiens (Human))
BDBM193179
PNG
(US10526329, Compound 194 | US11072611, Compound 19...)
Show SMILES CCc1nc2ccc(cn2c1N(C)c1nc(cs1)-c1ccc(F)cc1)C1CCN(CC(=O)NC2CC2)CC1
Show InChI InChI=1S/C29H33FN6OS/c1-3-24-28(34(2)29-33-25(18-38-29)20-4-7-22(30)8-5-20)36-16-21(6-11-26(36)32-24)19-12-14-35(15-13-19)17-27(37)31-23-9-10-23/h4-8,11,16,18-19,23H,3,9-10,12-15,17H2,1-2H3,(H,31,37)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.61E+3n/an/an/an/an/an/a



Galapagos SASU , 102 Avenue Gaston Roussel, 93230 Romainville, France.

Curated by ChEMBL


Assay Description
Inhibition of glycosylated human ATX using LPC 16:0 as substrate after 30 mins by luminescence assay


J Med Chem 60: 7371-7392 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00647
BindingDB Entry DOI: 10.7270/Q2R213VZ
More data for this
Ligand-Target Pair
Ectonucleotide pyrophosphatase/phosphodiesterase family member 2


(Homo sapiens (Human))
BDBM193179
PNG
(US10526329, Compound 194 | US11072611, Compound 19...)
Show SMILES CCc1nc2ccc(cn2c1N(C)c1nc(cs1)-c1ccc(F)cc1)C1CCN(CC(=O)NC2CC2)CC1
Show InChI InChI=1S/C29H33FN6OS/c1-3-24-28(34(2)29-33-25(18-38-29)20-4-7-22(30)8-5-20)36-16-21(6-11-26(36)32-24)19-12-14-35(15-13-19)17-27(37)31-23-9-10-23/h4-8,11,16,18-19,23H,3,9-10,12-15,17H2,1-2H3,(H,31,37)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
n/an/a 50n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Ectonucleotide pyrophosphatase/phosphodiesterase family member 2


(Homo sapiens (Human))
BDBM193179
PNG
(US10526329, Compound 194 | US11072611, Compound 19...)
Show SMILES CCc1nc2ccc(cn2c1N(C)c1nc(cs1)-c1ccc(F)cc1)C1CCN(CC(=O)NC2CC2)CC1
Show InChI InChI=1S/C29H33FN6OS/c1-3-24-28(34(2)29-33-25(18-38-29)20-4-7-22(30)8-5-20)36-16-21(6-11-26(36)32-24)19-12-14-35(15-13-19)17-27(37)31-23-9-10-23/h4-8,11,16,18-19,23H,3,9-10,12-15,17H2,1-2H3,(H,31,37)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 50n/an/an/an/an/an/a



GALAPAGOS NV

US Patent




US Patent US10526329 (2020)


BindingDB Entry DOI: 10.7270/Q2Z60RGR
More data for this
Ligand-Target Pair
Ectonucleotide pyrophosphatase/phosphodiesterase family member 2


(Homo sapiens (Human))
BDBM193179
PNG
(US10526329, Compound 194 | US11072611, Compound 19...)
Show SMILES CCc1nc2ccc(cn2c1N(C)c1nc(cs1)-c1ccc(F)cc1)C1CCN(CC(=O)NC2CC2)CC1
Show InChI InChI=1S/C29H33FN6OS/c1-3-24-28(34(2)29-33-25(18-38-29)20-4-7-22(30)8-5-20)36-16-21(6-11-26(36)32-24)19-12-14-35(15-13-19)17-27(37)31-23-9-10-23/h4-8,11,16,18-19,23H,3,9-10,12-15,17H2,1-2H3,(H,31,37)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
n/an/a>1.00E+3n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Ectonucleotide pyrophosphatase/phosphodiesterase family member 2


(Homo sapiens (Human))
BDBM193179
PNG
(US10526329, Compound 194 | US11072611, Compound 19...)
Show SMILES CCc1nc2ccc(cn2c1N(C)c1nc(cs1)-c1ccc(F)cc1)C1CCN(CC(=O)NC2CC2)CC1
Show InChI InChI=1S/C29H33FN6OS/c1-3-24-28(34(2)29-33-25(18-38-29)20-4-7-22(30)8-5-20)36-16-21(6-11-26(36)32-24)19-12-14-35(15-13-19)17-27(37)31-23-9-10-23/h4-8,11,16,18-19,23H,3,9-10,12-15,17H2,1-2H3,(H,31,37)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a>1.00E+3n/an/an/an/an/an/a



GALAPAGOS NV

US Patent


Assay Description
Compound IC50 values are determined in a hENPP2 (UniProtKB/SwissProt Sequence ref Q13822) biochemical assay using LPC as substrate.5 μL of a dil...


US Patent US10526329 (2020)


BindingDB Entry DOI: 10.7270/Q2Z60RGR
More data for this
Ligand-Target Pair