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SMILES: CC(C)n1cc(-c2[nH]c3ncccc3c2Cl)c2c(N)ncnc12

InChI Key: InChIKey=XVIXQCFZHSLBTO-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 6 hits for monomerid = 473702   
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))
BDBM473702
PNG
(5-(3-Chloro-1H-pyrrolo[2,3-b]pyridin-2-yl)- 7-isop...)
Show SMILES CC(C)n1cc(-c2[nH]c3ncccc3c2Cl)c2c(N)ncnc12
Show InChI InChI=1S/C16H15ClN6/c1-8(2)23-6-10(11-14(18)20-7-21-16(11)23)13-12(17)9-4-3-5-19-15(9)22-13/h3-8H,1-2H3,(H,19,22)(H2,18,20,21)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 1.10n/an/an/an/an/an/a



Cancer Research Technology Limited

US Patent


Assay Description
RET and KDR: Kinase activity was detected using CisBio HTRF kinEASE kit based on time-resolved fluorescence transfer (FRET). The assay was performed ...


US Patent US10844067 (2020)


BindingDB Entry DOI: 10.7270/Q2HQ4308
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (Human))
BDBM473702
PNG
(5-(3-Chloro-1H-pyrrolo[2,3-b]pyridin-2-yl)- 7-isop...)
Show SMILES CC(C)n1cc(-c2[nH]c3ncccc3c2Cl)c2c(N)ncnc12
Show InChI InChI=1S/C16H15ClN6/c1-8(2)23-6-10(11-14(18)20-7-21-16(11)23)13-12(17)9-4-3-5-19-15(9)22-13/h3-8H,1-2H3,(H,19,22)(H2,18,20,21)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 1.52E+3n/an/an/an/an/an/a



Cancer Research Technology Limited

US Patent


Assay Description
RET and KDR: Kinase activity was detected using CisBio HTRF kinEASE kit based on time-resolved fluorescence transfer (FRET). The assay was performed ...


US Patent US10844067 (2020)


BindingDB Entry DOI: 10.7270/Q2HQ4308
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase receptor Ret [V804M]


(Homo sapiens (Human))
BDBM473702
PNG
(5-(3-Chloro-1H-pyrrolo[2,3-b]pyridin-2-yl)- 7-isop...)
Show SMILES CC(C)n1cc(-c2[nH]c3ncccc3c2Cl)c2c(N)ncnc12
Show InChI InChI=1S/C16H15ClN6/c1-8(2)23-6-10(11-14(18)20-7-21-16(11)23)13-12(17)9-4-3-5-19-15(9)22-13/h3-8H,1-2H3,(H,19,22)(H2,18,20,21)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
n/an/a 26.1n/an/an/an/an/an/a


TBA



Citation and Details

BindingDB Entry DOI: 10.7270/Q28S4TVP
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase receptor Ret


(Homo sapiens (Human))
BDBM473702
PNG
(5-(3-Chloro-1H-pyrrolo[2,3-b]pyridin-2-yl)- 7-isop...)
Show SMILES CC(C)n1cc(-c2[nH]c3ncccc3c2Cl)c2c(N)ncnc12
Show InChI InChI=1S/C16H15ClN6/c1-8(2)23-6-10(11-14(18)20-7-21-16(11)23)13-12(17)9-4-3-5-19-15(9)22-13/h3-8H,1-2H3,(H,19,22)(H2,18,20,21)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
n/an/a 1.10n/an/an/an/an/an/a


TBA



Citation and Details

BindingDB Entry DOI: 10.7270/Q28S4TVP
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (Human))
BDBM473702
PNG
(5-(3-Chloro-1H-pyrrolo[2,3-b]pyridin-2-yl)- 7-isop...)
Show SMILES CC(C)n1cc(-c2[nH]c3ncccc3c2Cl)c2c(N)ncnc12
Show InChI InChI=1S/C16H15ClN6/c1-8(2)23-6-10(11-14(18)20-7-21-16(11)23)13-12(17)9-4-3-5-19-15(9)22-13/h3-8H,1-2H3,(H,19,22)(H2,18,20,21)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
n/an/a 1.52E+3n/an/an/an/an/an/a


TBA



Citation and Details

BindingDB Entry DOI: 10.7270/Q28S4TVP
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase receptor Ret [V804M]


(Homo sapiens (Human))
BDBM473702
PNG
(5-(3-Chloro-1H-pyrrolo[2,3-b]pyridin-2-yl)- 7-isop...)
Show SMILES CC(C)n1cc(-c2[nH]c3ncccc3c2Cl)c2c(N)ncnc12
Show InChI InChI=1S/C16H15ClN6/c1-8(2)23-6-10(11-14(18)20-7-21-16(11)23)13-12(17)9-4-3-5-19-15(9)22-13/h3-8H,1-2H3,(H,19,22)(H2,18,20,21)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 26.1n/an/an/an/an/an/a



Cancer Research Technology Limited

US Patent


Assay Description
RET and KDR: Kinase activity was detected using CisBio HTRF kinEASE kit based on time-resolved fluorescence transfer (FRET). The assay was performed ...


US Patent US10844067 (2020)


BindingDB Entry DOI: 10.7270/Q2HQ4308
More data for this
Ligand-Target Pair