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BDBM387323 1-methyl-N-[2-(pyridin-2-yl)pyrrolo[2,1-f][1,2,4]triazin-4-yl]-1H-1,3-benzodiazol-6-amine::US10292985, Example 7

SMILES: Cn1cnc2ccc(Nc3nc(nn4cccc34)-c3ccccn3)cc12

InChI Key: InChIKey=VZTIQKAGQVINGR-UHFFFAOYSA-N

Data: 2 IC50

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Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 387323   
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
TGF-beta receptor type II


(Homo sapiens (Human))
BDBM387323
PNG
(1-methyl-N-[2-(pyridin-2-yl)pyrrolo[2,1-f][1,2,4]t...)
Show SMILES Cn1cnc2ccc(Nc3nc(nn4cccc34)-c3ccccn3)cc12
Show InChI InChI=1S/C19H15N7/c1-25-12-21-14-8-7-13(11-17(14)25)22-19-16-6-4-10-26(16)24-18(23-19)15-5-2-3-9-20-15/h2-12H,1H3,(H,22,23,24)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a>1.50E+4n/an/an/an/an/an/a



University of Southern California





J Med Chem 52: 20-32 (2009)


BindingDB Entry DOI: 10.7270/Q28C9ZKH
More data for this
Ligand-Target Pair
TGF-beta receptor type-1


(Homo sapiens (Human))
BDBM387323
PNG
(1-methyl-N-[2-(pyridin-2-yl)pyrrolo[2,1-f][1,2,4]t...)
Show SMILES Cn1cnc2ccc(Nc3nc(nn4cccc34)-c3ccccn3)cc12
Show InChI InChI=1S/C19H15N7/c1-25-12-21-14-8-7-13(11-17(14)25)22-19-16-6-4-10-26(16)24-18(23-19)15-5-2-3-9-20-15/h2-12H,1H3,(H,22,23,24)
PDB
MMDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 240n/an/an/an/an/an/a



University of Southern California



Assay Description
Assays are conducted in 1536-well plates and 2 mL reactions are prepared from addition of HIS-TGFβR1 T204D or HIS-TGFβR2 WT, anti-HIS detec...


J Med Chem 52: 20-32 (2009)


BindingDB Entry DOI: 10.7270/Q28C9ZKH
More data for this
Ligand-Target Pair