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Patent code US10787453

Compile Data Set for Download or QSAR
Found 2 hits of Enzyme Inhibition Constant Data   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Retinol-binding protein 4


(Homo sapiens (Human))
BDBM464377
PNG
(US10787453, Compound 65)
Show SMILES Cc1ccc2nnc(C(=O)N3C[C@H]4CN(C[C@H]4C3)c3ccccc3C(F)(F)F)n2c1
Show InChI InChI=1S/C21H20F3N5O/c1-13-6-7-18-25-26-19(29(18)8-13)20(30)28-11-14-9-27(10-15(14)12-28)17-5-3-2-4-16(17)21(22,23)24/h2-8,14-15H,9-12H2,1H3/t14-,15+
PDB
MMDB

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PC cid
PC sid
UniChem
US Patent
n/an/a 1.68n/an/an/an/an/an/a



The Trustees of Columbia University in the City of New York

US Patent


Assay Description
Compound 65 and 66 were tested in two in vitro assays, RBP4 binding (SPA) and retinol-dependent RBP4-TTR interaction (HTRF). The compounds binded to ...


US Patent US10787453 (2020)

More data for this
Ligand-Target Pair
Retinol-binding protein 4


(Homo sapiens (Human))
BDBM50104159
PNG
(CHEMBL3594229 | US10787453, Compound 66)
Show SMILES COC(=O)c1cc(C)nc(n1)N1C[C@H]2CN(C[C@H]2C1)c1ccccc1C(F)(F)F
Show InChI InChI=1S/C20H21F3N4O2/c1-12-7-16(18(28)29-2)25-19(24-12)27-10-13-8-26(9-14(13)11-27)17-6-4-3-5-15(17)20(21,22)23/h3-7,13-14H,8-11H2,1-2H3/t13-,14+
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 3.90n/an/an/an/an/an/a



The Trustees of Columbia University in the City of New York

US Patent


Assay Description
Compound 65 and 66 were tested in two in vitro assays, RBP4 binding (SPA) and retinol-dependent RBP4-TTR interaction (HTRF). The compounds binded to ...


US Patent US10787453 (2020)

More data for this
Ligand-Target Pair
* indicates data uncertainty>20%