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Compile Data Set for Download or QSAR

Found 4 hits of ic50 for monomerid = 345844   
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
Proto-oncogene tyrosine-protein kinase receptor Ret


(Homo sapiens (Human))
BDBM345844
PNG
(US10202365, Compound 21 | US10774070, Compound 21)
Show SMILES Cc1cc(Nc2cc(C)nc(n2)-c2ccc(nc2)C(=O)NCc2cnc(cn2)-n2cc(F)cn2)n[nH]1
Show InChI InChI=1S/C23H20FN11O/c1-13-5-19(31-20-6-14(2)33-34-20)32-22(30-13)15-3-4-18(26-7-15)23(36)28-10-17-9-27-21(11-25-17)35-12-16(24)8-29-35/h3-9,11-12H,10H2,1-2H3,(H,28,36)(H2,30,31,32,33,34)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a<10n/an/an/an/an/an/a



BLUEPRINT MEDICINES CORPORATION

US Patent


Assay Description
In each well of a 384-well plate, 7.5 nM-10 nM of wild type RET (ProQinase 1090-0000-1) is incubated in a total of 12.5 μL of buffer (100 mM HEP...


US Patent US10202365 (2019)


BindingDB Entry DOI: 10.7270/Q2736T1G
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase receptor Ret [V804L]


(Homo sapiens (Human))
BDBM345844
PNG
(US10202365, Compound 21 | US10774070, Compound 21)
Show SMILES Cc1cc(Nc2cc(C)nc(n2)-c2ccc(nc2)C(=O)NCc2cnc(cn2)-n2cc(F)cn2)n[nH]1
Show InChI InChI=1S/C23H20FN11O/c1-13-5-19(31-20-6-14(2)33-34-20)32-22(30-13)15-3-4-18(26-7-15)23(36)28-10-17-9-27-21(11-25-17)35-12-16(24)8-29-35/h3-9,11-12H,10H2,1-2H3,(H,28,36)(H2,30,31,32,33,34)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a<10n/an/an/an/an/an/a



BLUEPRINT MEDICINES CORPORATION

US Patent


Assay Description
In each well of a 384-well plate, 7.5 nM-10 nM of mutant RET (ProQinase 1096-0000-1) is incubated in a total of 12.5 μL of buffer (100 mM HEPES ...


US Patent US10774070 (2020)


BindingDB Entry DOI: 10.7270/Q2HM5CHN
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase receptor Ret


(Homo sapiens (Human))
BDBM345844
PNG
(US10202365, Compound 21 | US10774070, Compound 21)
Show SMILES Cc1cc(Nc2cc(C)nc(n2)-c2ccc(nc2)C(=O)NCc2cnc(cn2)-n2cc(F)cn2)n[nH]1
Show InChI InChI=1S/C23H20FN11O/c1-13-5-19(31-20-6-14(2)33-34-20)32-22(30-13)15-3-4-18(26-7-15)23(36)28-10-17-9-27-21(11-25-17)35-12-16(24)8-29-35/h3-9,11-12H,10H2,1-2H3,(H,28,36)(H2,30,31,32,33,34)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a<10n/an/an/an/an/an/a



BLUEPRINT MEDICINES CORPORATION

US Patent


Assay Description
In each well of a 384-well plate, 7.5 nM-10 nM of wild type RET (ProQinase 1090-0000-1) is incubated in a total of 12.5 μL of buffer (100 mM HEP...


US Patent US10774070 (2020)


BindingDB Entry DOI: 10.7270/Q2HM5CHN
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase receptor Ret [V804L]


(Homo sapiens (Human))
BDBM345844
PNG
(US10202365, Compound 21 | US10774070, Compound 21)
Show SMILES Cc1cc(Nc2cc(C)nc(n2)-c2ccc(nc2)C(=O)NCc2cnc(cn2)-n2cc(F)cn2)n[nH]1
Show InChI InChI=1S/C23H20FN11O/c1-13-5-19(31-20-6-14(2)33-34-20)32-22(30-13)15-3-4-18(26-7-15)23(36)28-10-17-9-27-21(11-25-17)35-12-16(24)8-29-35/h3-9,11-12H,10H2,1-2H3,(H,28,36)(H2,30,31,32,33,34)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a<10n/an/an/an/an/an/a



BLUEPRINT MEDICINES CORPORATION

US Patent


Assay Description
In each well of a 384-well plate, 7.5 nM-10 nM of mutant RET (ProQinase 1096-0000-1) is incubated in a total of 12.5 μL of buffer (100 mM HEPES ...


US Patent US10202365 (2019)


BindingDB Entry DOI: 10.7270/Q2736T1G
More data for this
Ligand-Target Pair