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SMILES: CCOc1cc(-c2ccc(nc2)N2CCC3(CN3S(=O)(=O)c3ccc(OC)cc3)CC2)c2c(cnn2c1)C#N

InChI Key: InChIKey=SRXXGPMOBLVIBK-UHFFFAOYSA-N

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 15 hits for monomerid = 296777   
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
Proto-oncogene tyrosine-protein kinase receptor Ret


(Homo sapiens (Human))
BDBM296777
PNG
(6-ethoxy-4-(6-(1-((4- methoxyphenyl) sulfonyl)-1,6...)
Show SMILES CCOc1cc(-c2ccc(nc2)N2CCC3(CN3S(=O)(=O)c3ccc(OC)cc3)CC2)c2c(cnn2c1)C#N
Show InChI InChI=1S/C28H28N6O4S/c1-3-38-23-14-25(27-21(15-29)17-31-33(27)18-23)20-4-9-26(30-16-20)32-12-10-28(11-13-32)19-34(28)39(35,36)24-7-5-22(37-2)6-8-24/h4-9,14,16-18H,3,10-13,19H2,1-2H3
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n/an/a 38n/an/an/an/a7.4n/a



Array BioPharma Inc.

US Patent


Assay Description
Compounds of Formula I were screened for their ability to inhibit wildtype and V804M mutant RET kinase using CisBio's HTRF® KinEASE¿-TK assay tec...


US Patent US10112942 (2018)


BindingDB Entry DOI: 10.7270/Q2S75JB5
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase receptor Ret [G810R]


(Homo sapiens (Human))
BDBM296777
PNG
(6-ethoxy-4-(6-(1-((4- methoxyphenyl) sulfonyl)-1,6...)
Show SMILES CCOc1cc(-c2ccc(nc2)N2CCC3(CN3S(=O)(=O)c3ccc(OC)cc3)CC2)c2c(cnn2c1)C#N
Show InChI InChI=1S/C28H28N6O4S/c1-3-38-23-14-25(27-21(15-29)17-31-33(27)18-23)20-4-9-26(30-16-20)32-12-10-28(11-13-32)19-34(28)39(35,36)24-7-5-22(37-2)6-8-24/h4-9,14,16-18H,3,10-13,19H2,1-2H3
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n/an/a 380n/an/an/an/an/an/a



Array Biopharma Inc.

US Patent


Assay Description
RET G810R: The potency of a compound inhibiting G810R mutant RET kinase was determined using CisBio's HTRF Kinease-TK assay technology. The assay...


US Patent US10953005 (2021)

More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase receptor Ret [G810R]


(Homo sapiens (Human))
BDBM296777
PNG
(6-ethoxy-4-(6-(1-((4- methoxyphenyl) sulfonyl)-1,6...)
Show SMILES CCOc1cc(-c2ccc(nc2)N2CCC3(CN3S(=O)(=O)c3ccc(OC)cc3)CC2)c2c(cnn2c1)C#N
Show InChI InChI=1S/C28H28N6O4S/c1-3-38-23-14-25(27-21(15-29)17-31-33(27)18-23)20-4-9-26(30-16-20)32-12-10-28(11-13-32)19-34(28)39(35,36)24-7-5-22(37-2)6-8-24/h4-9,14,16-18H,3,10-13,19H2,1-2H3
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PC sid
UniChem
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n/an/a 380n/an/an/an/an/an/a



Array BioPharma Inc.

US Patent




US Patent US10112942 (2018)


BindingDB Entry DOI: 10.7270/Q2S75JB5
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase receptor Ret


(Homo sapiens (Human))
BDBM296777
PNG
(6-ethoxy-4-(6-(1-((4- methoxyphenyl) sulfonyl)-1,6...)
Show SMILES CCOc1cc(-c2ccc(nc2)N2CCC3(CN3S(=O)(=O)c3ccc(OC)cc3)CC2)c2c(cnn2c1)C#N
Show InChI InChI=1S/C28H28N6O4S/c1-3-38-23-14-25(27-21(15-29)17-31-33(27)18-23)20-4-9-26(30-16-20)32-12-10-28(11-13-32)19-34(28)39(35,36)24-7-5-22(37-2)6-8-24/h4-9,14,16-18H,3,10-13,19H2,1-2H3
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KEGG

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PC sid
UniChem
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n/an/a 38n/an/an/an/an/an/a



Array BioPharma Inc.

US Patent


Assay Description
Compounds of Formula I were screened for their ability to inhibit wildtype and V804M mutant RET kinase using CisBio's HTRF® KinEASE¿-TK assay tec...


US Patent US10137124 (2018)


BindingDB Entry DOI: 10.7270/Q28S4RZ6
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase receptor Ret [V804M]


(Homo sapiens (Human))
BDBM296777
PNG
(6-ethoxy-4-(6-(1-((4- methoxyphenyl) sulfonyl)-1,6...)
Show SMILES CCOc1cc(-c2ccc(nc2)N2CCC3(CN3S(=O)(=O)c3ccc(OC)cc3)CC2)c2c(cnn2c1)C#N
Show InChI InChI=1S/C28H28N6O4S/c1-3-38-23-14-25(27-21(15-29)17-31-33(27)18-23)20-4-9-26(30-16-20)32-12-10-28(11-13-32)19-34(28)39(35,36)24-7-5-22(37-2)6-8-24/h4-9,14,16-18H,3,10-13,19H2,1-2H3
PDB

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PC cid
PC sid
UniChem
US Patent
n/an/a 224n/an/an/an/an/an/a



Array BioPharma Inc.

US Patent


Assay Description
Compounds of Formula I were screened for their ability to inhibit wildtype and V804M mutant RET kinase using CisBio's HTRF® KinEASE¿-TK assay tec...


US Patent US10137124 (2018)


BindingDB Entry DOI: 10.7270/Q28S4RZ6
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase receptor Ret [G810R]


(Homo sapiens (Human))
BDBM296777
PNG
(6-ethoxy-4-(6-(1-((4- methoxyphenyl) sulfonyl)-1,6...)
Show SMILES CCOc1cc(-c2ccc(nc2)N2CCC3(CN3S(=O)(=O)c3ccc(OC)cc3)CC2)c2c(cnn2c1)C#N
Show InChI InChI=1S/C28H28N6O4S/c1-3-38-23-14-25(27-21(15-29)17-31-33(27)18-23)20-4-9-26(30-16-20)32-12-10-28(11-13-32)19-34(28)39(35,36)24-7-5-22(37-2)6-8-24/h4-9,14,16-18H,3,10-13,19H2,1-2H3
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 380n/an/an/an/an/an/a



Array BioPharma Inc.

US Patent


Assay Description
Compounds of Formula I were screened for their ability to inhibit wildtype and V804M mutant RET kinase using CisBio's HTRF® KinEASE¿-TK assay tec...


US Patent US10137124 (2018)


BindingDB Entry DOI: 10.7270/Q28S4RZ6
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase receptor Ret [658-1114]


(Homo sapiens (Human))
BDBM296777
PNG
(6-ethoxy-4-(6-(1-((4- methoxyphenyl) sulfonyl)-1,6...)
Show SMILES CCOc1cc(-c2ccc(nc2)N2CCC3(CN3S(=O)(=O)c3ccc(OC)cc3)CC2)c2c(cnn2c1)C#N
Show InChI InChI=1S/C28H28N6O4S/c1-3-38-23-14-25(27-21(15-29)17-31-33(27)18-23)20-4-9-26(30-16-20)32-12-10-28(11-13-32)19-34(28)39(35,36)24-7-5-22(37-2)6-8-24/h4-9,14,16-18H,3,10-13,19H2,1-2H3
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 38n/an/an/an/an/an/a



Array BioPharma Inc.

US Patent


Assay Description
Compounds of Formula I were screened for their ability to inhibit wildtype and V804M mutant RET kinase using CisBio's HTRF KinEASE -TK assay tech...


US Patent US10172851 (2019)


BindingDB Entry DOI: 10.7270/Q2GM89CV
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase receptor Ret [658-1114,V804M]


(Homo sapiens (Human))
BDBM296777
PNG
(6-ethoxy-4-(6-(1-((4- methoxyphenyl) sulfonyl)-1,6...)
Show SMILES CCOc1cc(-c2ccc(nc2)N2CCC3(CN3S(=O)(=O)c3ccc(OC)cc3)CC2)c2c(cnn2c1)C#N
Show InChI InChI=1S/C28H28N6O4S/c1-3-38-23-14-25(27-21(15-29)17-31-33(27)18-23)20-4-9-26(30-16-20)32-12-10-28(11-13-32)19-34(28)39(35,36)24-7-5-22(37-2)6-8-24/h4-9,14,16-18H,3,10-13,19H2,1-2H3
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 224n/an/an/an/an/an/a



Array BioPharma Inc.

US Patent


Assay Description
Compounds of Formula I were screened for their ability to inhibit wildtype and V804M mutant RET kinase using CisBio's HTRF KinEASE -TK assay tech...


US Patent US10172851 (2019)


BindingDB Entry DOI: 10.7270/Q2GM89CV
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase receptor Ret [G810R]


(Homo sapiens (Human))
BDBM296777
PNG
(6-ethoxy-4-(6-(1-((4- methoxyphenyl) sulfonyl)-1,6...)
Show SMILES CCOc1cc(-c2ccc(nc2)N2CCC3(CN3S(=O)(=O)c3ccc(OC)cc3)CC2)c2c(cnn2c1)C#N
Show InChI InChI=1S/C28H28N6O4S/c1-3-38-23-14-25(27-21(15-29)17-31-33(27)18-23)20-4-9-26(30-16-20)32-12-10-28(11-13-32)19-34(28)39(35,36)24-7-5-22(37-2)6-8-24/h4-9,14,16-18H,3,10-13,19H2,1-2H3
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 380n/an/an/an/an/an/a



Array BioPharma Inc.

US Patent


Assay Description
The potency of a compound inhibiting G81 OR mutant RET kinase was determined using CisBio's HTRF Kinease-TK assay technology. The assays containe...


US Patent US10172851 (2019)


BindingDB Entry DOI: 10.7270/Q2GM89CV
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase receptor Ret [658-1114]


(Homo sapiens (Human))
BDBM296777
PNG
(6-ethoxy-4-(6-(1-((4- methoxyphenyl) sulfonyl)-1,6...)
Show SMILES CCOc1cc(-c2ccc(nc2)N2CCC3(CN3S(=O)(=O)c3ccc(OC)cc3)CC2)c2c(cnn2c1)C#N
Show InChI InChI=1S/C28H28N6O4S/c1-3-38-23-14-25(27-21(15-29)17-31-33(27)18-23)20-4-9-26(30-16-20)32-12-10-28(11-13-32)19-34(28)39(35,36)24-7-5-22(37-2)6-8-24/h4-9,14,16-18H,3,10-13,19H2,1-2H3
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 38n/an/an/an/an/an/a



Eli Lilly and Company

US Patent


Assay Description
Compounds of Formula I were screened for their ability to inhibit wildtype and V804M mutant RET kinase using CisBio's HTRF KinEASE-TK assay techn...


US Patent US10555944 (2020)


BindingDB Entry DOI: 10.7270/Q279473N
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase receptor Ret [658-1114,V804M]


(Homo sapiens (Human))
BDBM296777
PNG
(6-ethoxy-4-(6-(1-((4- methoxyphenyl) sulfonyl)-1,6...)
Show SMILES CCOc1cc(-c2ccc(nc2)N2CCC3(CN3S(=O)(=O)c3ccc(OC)cc3)CC2)c2c(cnn2c1)C#N
Show InChI InChI=1S/C28H28N6O4S/c1-3-38-23-14-25(27-21(15-29)17-31-33(27)18-23)20-4-9-26(30-16-20)32-12-10-28(11-13-32)19-34(28)39(35,36)24-7-5-22(37-2)6-8-24/h4-9,14,16-18H,3,10-13,19H2,1-2H3
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 224n/an/an/an/an/an/a



Eli Lilly and Company

US Patent


Assay Description
Compounds of Formula I were screened for their ability to inhibit wildtype and V804M mutant RET kinase using CisBio's HTRF KinEASE-TK assay techn...


US Patent US10555944 (2020)


BindingDB Entry DOI: 10.7270/Q279473N
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase receptor Ret [658-1114,G810R]


(Homo sapiens (Human))
BDBM296777
PNG
(6-ethoxy-4-(6-(1-((4- methoxyphenyl) sulfonyl)-1,6...)
Show SMILES CCOc1cc(-c2ccc(nc2)N2CCC3(CN3S(=O)(=O)c3ccc(OC)cc3)CC2)c2c(cnn2c1)C#N
Show InChI InChI=1S/C28H28N6O4S/c1-3-38-23-14-25(27-21(15-29)17-31-33(27)18-23)20-4-9-26(30-16-20)32-12-10-28(11-13-32)19-34(28)39(35,36)24-7-5-22(37-2)6-8-24/h4-9,14,16-18H,3,10-13,19H2,1-2H3
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 380n/an/an/an/an/an/a



Eli Lilly and Company

US Patent


Assay Description
The potency of a compound inhibiting G81 OR mutant RET kinase was determined using CisBio's HTRF Kinease-TK assay technology. The assays containe...


US Patent US10555944 (2020)


BindingDB Entry DOI: 10.7270/Q279473N
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase receptor Ret


(Homo sapiens (Human))
BDBM296777
PNG
(6-ethoxy-4-(6-(1-((4- methoxyphenyl) sulfonyl)-1,6...)
Show SMILES CCOc1cc(-c2ccc(nc2)N2CCC3(CN3S(=O)(=O)c3ccc(OC)cc3)CC2)c2c(cnn2c1)C#N
Show InChI InChI=1S/C28H28N6O4S/c1-3-38-23-14-25(27-21(15-29)17-31-33(27)18-23)20-4-9-26(30-16-20)32-12-10-28(11-13-32)19-34(28)39(35,36)24-7-5-22(37-2)6-8-24/h4-9,14,16-18H,3,10-13,19H2,1-2H3
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 38n/an/an/an/an/an/a



Array Biopharma Inc.

US Patent


Assay Description
RET: Compounds of Formula I were screened for their ability to inhibit wildtype and V804M mutant RET kinase using CisBio's HTRF® KinEASE™-TK assa...


US Patent US10953005 (2021)

More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase receptor Ret [658-1114,V804M]


(Homo sapiens (Human))
BDBM296777
PNG
(6-ethoxy-4-(6-(1-((4- methoxyphenyl) sulfonyl)-1,6...)
Show SMILES CCOc1cc(-c2ccc(nc2)N2CCC3(CN3S(=O)(=O)c3ccc(OC)cc3)CC2)c2c(cnn2c1)C#N
Show InChI InChI=1S/C28H28N6O4S/c1-3-38-23-14-25(27-21(15-29)17-31-33(27)18-23)20-4-9-26(30-16-20)32-12-10-28(11-13-32)19-34(28)39(35,36)24-7-5-22(37-2)6-8-24/h4-9,14,16-18H,3,10-13,19H2,1-2H3
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 224n/an/an/an/an/an/a



Array Biopharma Inc.

US Patent


Assay Description
RET: Compounds of Formula I were screened for their ability to inhibit wildtype and V804M mutant RET kinase using CisBio's HTRF® KinEASE™-TK assa...


US Patent US10953005 (2021)

More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase receptor Ret [V804M]


(Homo sapiens (Human))
BDBM296777
PNG
(6-ethoxy-4-(6-(1-((4- methoxyphenyl) sulfonyl)-1,6...)
Show SMILES CCOc1cc(-c2ccc(nc2)N2CCC3(CN3S(=O)(=O)c3ccc(OC)cc3)CC2)c2c(cnn2c1)C#N
Show InChI InChI=1S/C28H28N6O4S/c1-3-38-23-14-25(27-21(15-29)17-31-33(27)18-23)20-4-9-26(30-16-20)32-12-10-28(11-13-32)19-34(28)39(35,36)24-7-5-22(37-2)6-8-24/h4-9,14,16-18H,3,10-13,19H2,1-2H3
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 224n/an/an/an/an/an/a



Array BioPharma Inc.

US Patent




US Patent US10112942 (2018)


BindingDB Entry DOI: 10.7270/Q2S75JB5
More data for this
Ligand-Target Pair