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BDBM192959 US10526329, Compound 154::US9670204, 154 1-(4-(2-ethyl-3-((4-(4-fluorophenyl)-5-(hydroxymethyl)thiazol-2-yl)(methyl)amino)imidazo[1,2-a]pyridin-6-yl)piperidin-1-yl)propan-1-one

SMILES: CCC(=O)N1CCC(CC1)c1ccc2nc(CC)c(N(C)c3nc(c(CO)s3)-c3ccc(F)cc3)n2c1

InChI Key: InChIKey=GXUIEVJTBWWWPA-UHFFFAOYSA-N

Data: 2 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 2 hits for monomerid = 192959   
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))
BDBM192959
PNG
(US10526329, Compound 154 | US9670204, 154 1-(4-(2-...)
Show SMILES CCC(=O)N1CCC(CC1)c1ccc2nc(CC)c(N(C)c3nc(c(CO)s3)-c3ccc(F)cc3)n2c1
Show InChI InChI=1S/C28H32FN5O2S/c1-4-22-27(32(3)28-31-26(23(17-35)37-28)19-6-9-21(29)10-7-19)34-16-20(8-11-24(34)30-22)18-12-14-33(15-13-18)25(36)5-2/h6-11,16,18,35H,4-5,12-15,17H2,1-3H3
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 300n/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
Ectonucleotide pyrophosphatase/phosphodiesterase family member 2


(Homo sapiens (Human))
BDBM192959
PNG
(US10526329, Compound 154 | US9670204, 154 1-(4-(2-...)
Show SMILES CCC(=O)N1CCC(CC1)c1ccc2nc(CC)c(N(C)c3nc(c(CO)s3)-c3ccc(F)cc3)n2c1
Show InChI InChI=1S/C28H32FN5O2S/c1-4-22-27(32(3)28-31-26(23(17-35)37-28)19-6-9-21(29)10-7-19)34-16-20(8-11-24(34)30-22)18-12-14-33(15-13-18)25(36)5-2/h6-11,16,18,35H,4-5,12-15,17H2,1-3H3
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 300n/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