BindingDB logo
myBDB logout

null

SMILES: COc1cc(ncc1Oc1ccc(OC(F)(F)F)cc1)C(=O)N1CCC(CC1)c1ccc(N)nn1

InChI Key: InChIKey=JKGMPLDOMCXRIO-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 2 hits for monomerid = 466665   
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
Short transient receptor potential channel 6


(Homo sapiens (Human))
BDBM466665
PNG
(US10800757, Compound 80 | US10889568, Compound 80 ...)
Show SMILES COc1cc(ncc1Oc1ccc(OC(F)(F)F)cc1)C(=O)N1CCC(CC1)c1ccc(N)nn1
Show InChI InChI=1S/C23H22F3N5O4/c1-33-19-12-18(22(32)31-10-8-14(9-11-31)17-6-7-21(27)30-29-17)28-13-20(19)34-15-2-4-16(5-3-15)35-23(24,25)26/h2-7,12-14H,8-11H2,1H3,(H2,27,30)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a<27n/an/an/an/an/an/a



Boehringer Ingelheim International GmbH; Hydra Biosciences, LLC

US Patent


Assay Description
This screening assay measures TRPC6 (transient receptor potential cation channel, subfamily C, member 6) ion channel activation via addition either o...


US Patent US10800757 (2020)

More data for this
Ligand-Target Pair
Short transient receptor potential channel 6


(Homo sapiens (Human))
BDBM466665
PNG
(US10800757, Compound 80 | US10889568, Compound 80 ...)
Show SMILES COc1cc(ncc1Oc1ccc(OC(F)(F)F)cc1)C(=O)N1CCC(CC1)c1ccc(N)nn1
Show InChI InChI=1S/C23H22F3N5O4/c1-33-19-12-18(22(32)31-10-8-14(9-11-31)17-6-7-21(27)30-29-17)28-13-20(19)34-15-2-4-16(5-3-15)35-23(24,25)26/h2-7,12-14H,8-11H2,1H3,(H2,27,30)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a<27n/an/an/an/an/an/a



Boehringer Ingelheim International GmbH

US Patent


Assay Description
The commercially available HEK293/TREx line (Invitrogen) was stably transfected with a TRPC6 construct and screened by conventional calcium imaging t...


US Patent US10889568 (2021)

More data for this
Ligand-Target Pair