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BDBM192921 US10526329, Compound 135::US9670204, 135 5-bromo-N-(2-ethyl-6-(1-(methylsulfonyl)piperidin-4-yl)imidazo[1,2-a]pyridin-3-yl)-4-(4-fluorophenyl)-N-methylthiazol-2-amine

SMILES: CCc1nc2ccc(cn2c1N(C)c1nc(c(Br)s1)-c1ccc(F)cc1)C1CCN(CC1)S(C)(=O)=O

InChI Key: InChIKey=ATFQRRQFGVGREC-UHFFFAOYSA-N

Data: 3 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 3 hits for monomerid = 192921   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Ectonucleotide pyrophosphatase/phosphodiesterase family member 2


(Homo sapiens (Human))
BDBM192921
PNG
(US10526329, Compound 135 | US9670204, 135 5-bromo-...)
Show SMILES CCc1nc2ccc(cn2c1N(C)c1nc(c(Br)s1)-c1ccc(F)cc1)C1CCN(CC1)S(C)(=O)=O
Show InChI InChI=1S/C25H27BrFN5O2S2/c1-4-20-24(30(2)25-29-22(23(26)35-25)17-5-8-19(27)9-6-17)32-15-18(7-10-21(32)28-20)16-11-13-31(14-12-16)36(3,33)34/h5-10,15-16H,4,11-14H2,1-3H3
PDB

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UniProtKB/SwissProt

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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))
BDBM192921
PNG
(US10526329, Compound 135 | US9670204, 135 5-bromo-...)
Show SMILES CCc1nc2ccc(cn2c1N(C)c1nc(c(Br)s1)-c1ccc(F)cc1)C1CCN(CC1)S(C)(=O)=O
Show InChI InChI=1S/C25H27BrFN5O2S2/c1-4-20-24(30(2)25-29-22(23(26)35-25)17-5-8-19(27)9-6-17)32-15-18(7-10-21(32)28-20)16-11-13-31(14-12-16)36(3,33)34/h5-10,15-16H,4,11-14H2,1-3H3
PDB

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UniProtKB/SwissProt

antibodypedia
GoogleScholar
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))
BDBM192921
PNG
(US10526329, Compound 135 | US9670204, 135 5-bromo-...)
Show SMILES CCc1nc2ccc(cn2c1N(C)c1nc(c(Br)s1)-c1ccc(F)cc1)C1CCN(CC1)S(C)(=O)=O
Show InChI InChI=1S/C25H27BrFN5O2S2/c1-4-20-24(30(2)25-29-22(23(26)35-25)17-5-8-19(27)9-6-17)32-15-18(7-10-21(32)28-20)16-11-13-31(14-12-16)36(3,33)34/h5-10,15-16H,4,11-14H2,1-3H3
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
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