BindingDB logo
myBDB logout

BDBM160523 US10280160, Example 15.::US9682969, 15

SMILES: Cc1nc2ccc(cc2o1)N(C1CC1)C(=O)Cn1nc(-c2cccc(Cl)c2)c2ccc(O)cc2c1=O

InChI Key: InChIKey=TVHQFJMUNNVMTG-UHFFFAOYSA-N

Data: 2 EC50

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 = 160523   
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
Cystic fibrosis transmembrane conductance regulator


(Homo sapiens (Human))
BDBM160523
PNG
(US10280160, Example 15. | US9682969, 15)
Show SMILES Cc1nc2ccc(cc2o1)N(C1CC1)C(=O)Cn1nc(-c2cccc(Cl)c2)c2ccc(O)cc2c1=O
Show InChI InChI=1S/C27H21ClN4O4/c1-15-29-23-10-7-19(12-24(23)36-15)32(18-5-6-18)25(34)14-31-27(35)22-13-20(33)8-9-21(22)26(30-31)16-3-2-4-17(28)11-16/h2-4,7-13,18,33H,5-6,14H2,1H3
PDB

Reactome pathway

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/an/an/a<1.00E+4n/an/an/an/a



Flatley Discovery Lab LLC

US Patent


Assay Description
Fisher Rat Thyroid (FRT) cells stably expressing both human F508del CFTR and a halide-sensitive yellow fluorescent protein (YFP-H148Q/I152L 25,22) (G...


US Patent US10280160 (2019)


BindingDB Entry DOI: 10.7270/Q2M047SX
More data for this
Ligand-Target Pair
CFTR F508del


(Homo sapiens (Human))
BDBM160523
PNG
(US10280160, Example 15. | US9682969, 15)
Show SMILES Cc1nc2ccc(cc2o1)N(C1CC1)C(=O)Cn1nc(-c2cccc(Cl)c2)c2ccc(O)cc2c1=O
Show InChI InChI=1S/C27H21ClN4O4/c1-15-29-23-10-7-19(12-24(23)36-15)32(18-5-6-18)25(34)14-31-27(35)22-13-20(33)8-9-21(22)26(30-31)16-3-2-4-17(28)11-16/h2-4,7-13,18,33H,5-6,14H2,1H3
PDB

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/an/an/a<1.00E+4n/an/an/an/a



Flatley Discovery Lab LLC

US Patent


Assay Description
This protocol is designed to selectively screen small molecule compounds for F508del CFTR corrector activities in the YFP (yellow fluorescent protein...


US Patent US9682969 (2017)


BindingDB Entry DOI: 10.7270/Q2SQ8XKT
More data for this
Ligand-Target Pair