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BDBM387331 6-chloro-N-[2-(6-methylpyridin-2-yl)pyrrolo[2,1-f][1,2,4]triazin-4-yl]quinolin-4-amine::US10292985, Example 15

SMILES: Cc1cccc(n1)-c1nc(Nc2ccnc3ccc(Cl)cc23)c2cccn2n1

InChI Key: InChIKey=AJRHVKPLEGOWCQ-UHFFFAOYSA-N

Data: 2 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 2 hits for monomerid = 387331   
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))
BDBM387331
PNG
(6-chloro-N-[2-(6-methylpyridin-2-yl)pyrrolo[2,1-f]...)
Show SMILES Cc1cccc(n1)-c1nc(Nc2ccnc3ccc(Cl)cc23)c2cccn2n1
Show InChI InChI=1S/C21H15ClN6/c1-13-4-2-5-18(24-13)20-26-21(19-6-3-11-28(19)27-20)25-17-9-10-23-16-8-7-14(22)12-15(16)17/h2-12H,1H3,(H,23,25,26,27)
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))
BDBM387331
PNG
(6-chloro-N-[2-(6-methylpyridin-2-yl)pyrrolo[2,1-f]...)
Show SMILES Cc1cccc(n1)-c1nc(Nc2ccnc3ccc(Cl)cc23)c2cccn2n1
Show InChI InChI=1S/C21H15ClN6/c1-13-4-2-5-18(24-13)20-26-21(19-6-3-11-28(19)27-20)25-17-9-10-23-16-8-7-14(22)12-15(16)17/h2-12H,1H3,(H,23,25,26,27)
PDB
MMDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 4.70n/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