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BDBM340540 US9771316, Example 29

SMILES: NCCCCC(Oc1ccc(c(F)c1)C(F)(F)F)c1ccccc1

InChI Key: InChIKey=ABFRUASEKCQILF-UHFFFAOYSA-N

Data: 2 IC50

Find this compound or compounds like it in BindingDB or PDB:
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 340540   
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
Large neutral amino acids transporter small subunit 2


(Homo sapiens (Human))
BDBM340540
PNG
(US9771316, Example 29)
Show SMILES NCCCCC(Oc1ccc(c(F)c1)C(F)(F)F)c1ccccc1
Show InChI InChI=1S/C18H19F4NO/c19-16-12-14(9-10-15(16)18(20,21)22)24-17(8-4-5-11-23)13-6-2-1-3-7-13/h1-3,6-7,9-10,12,17H,4-5,8,11,23H2
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
PC cid
PC sid
UniChem
Article
US Patent
n/an/a 2.18E+5n/an/an/an/an/an/a



Osaka University; KNC Laboratories Co., Ltd.

US Patent




US Patent US9771316 (2017)


Article DOI: 10.1021/bi060173m
More data for this
Ligand-Target Pair
Large neutral amino acids transporter small subunit 1


(Homo sapiens (Human))
BDBM340540
PNG
(US9771316, Example 29)
Show SMILES NCCCCC(Oc1ccc(c(F)c1)C(F)(F)F)c1ccccc1
Show InChI InChI=1S/C18H19F4NO/c19-16-12-14(9-10-15(16)18(20,21)22)24-17(8-4-5-11-23)13-6-2-1-3-7-13/h1-3,6-7,9-10,12,17H,4-5,8,11,23H2
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
Article
US Patent
n/an/a 7.60E+4n/an/an/an/an/an/a



Osaka University; KNC Laboratories Co., Ltd.

US Patent


Assay Description
Expression vector each expressing a gene was inserted using Lipofectamine 2000 (Invitrogen) to cultured cell line HEK293 cell derived from human fetu...


US Patent US9771316 (2017)


Article DOI: 10.1021/bi060173m
More data for this
Ligand-Target Pair