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SMILES: COC(=O)C[C@@H](O)[C@H](Cc1ccccc1)N(C)C(=O)OCc1ccccc1

InChI Key: InChIKey=NTFJSFAGMHDILF-RBUKOAKNSA-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 = 50403701   
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
ATP-dependent translocase ABCB1


(Homo sapiens (Human))
BDBM50403701
PNG
(CHEMBL37969)
Show SMILES COC(=O)C[C@@H](O)[C@H](Cc1ccccc1)N(C)C(=O)OCc1ccccc1
Show InChI InChI=1S/C21H25NO5/c1-22(21(25)27-15-17-11-7-4-8-12-17)18(19(23)14-20(24)26-2)13-16-9-5-3-6-10-16/h3-12,18-19,23H,13-15H2,1-2H3/t18-,19+/m0/s1
PDB

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/a 1.71E+4n/an/an/an/an/an/a



Eisai Research Institute

Curated by ChEMBL


Assay Description
Multidrug-resistant reversal activity using P388/VMDRC.04 cells (a subline of P388 murine leukemia cells expressing human recombinant human P-glycopr...


Bioorg Med Chem Lett 9: 1541-6 (1999)


BindingDB Entry DOI: 10.7270/Q22R3ST7
More data for this
Ligand-Target Pair
ATP-dependent translocase ABCB1


(Homo sapiens (Human))
BDBM50403701
PNG
(CHEMBL37969)
Show SMILES COC(=O)C[C@@H](O)[C@H](Cc1ccccc1)N(C)C(=O)OCc1ccccc1
Show InChI InChI=1S/C21H25NO5/c1-22(21(25)27-15-17-11-7-4-8-12-17)18(19(23)14-20(24)26-2)13-16-9-5-3-6-10-16/h3-12,18-19,23H,13-15H2,1-2H3/t18-,19+/m0/s1
PDB

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/a>8.90E+4n/an/an/an/an/an/a



Eisai Research Institute

Curated by ChEMBL


Assay Description
Multidrug-resistant reversal activity using P388/VMDRC.04 cells (a subline of P388 murine leukemia cells expressing human recombinant human P-glycopr...


Bioorg Med Chem Lett 9: 1541-6 (1999)


BindingDB Entry DOI: 10.7270/Q22R3ST7
More data for this
Ligand-Target Pair