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BDBM49069 7-methoxy-8-methyl-4-(trifluoromethyl)-1-benzopyran-2-one::7-methoxy-8-methyl-4-(trifluoromethyl)-2H-chromen-2-one::7-methoxy-8-methyl-4-(trifluoromethyl)chromen-2-one::7-methoxy-8-methyl-4-(trifluoromethyl)coumarin::MLS000066813::SMR000070904::cid_881569

SMILES: COc1ccc2c(cc(=O)oc2c1C)C(F)(F)F

InChI Key: InChIKey=KAIHCWSEKNEATL-UHFFFAOYSA-N

Data: 1 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 1 hit for monomerid = 49069   
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
D(1A) dopamine receptor


(Homo sapiens (Human))
BDBM49069
PNG
(7-methoxy-8-methyl-4-(trifluoromethyl)-1-benzopyra...)
Show SMILES COc1ccc2c(cc(=O)oc2c1C)C(F)(F)F
Show InChI InChI=1S/C12H9F3O3/c1-6-9(17-2)4-3-7-8(12(13,14)15)5-10(16)18-11(6)7/h3-5H,1-2H3
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/an/an/a 0.0194n/an/an/an/a



Vanderbilt Screening Center for GPCRs, Ion Channels and Transporters

Curated by PubChem BioAssay


Assay Description
Assay Provider: Val Watts Assay Provider Affiliation: Purdue University Grant Title: Allosteric Modulators of D1 Receptors Grant Number: 1 X01 MH0776...


PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q2H41PVH
More data for this
Ligand-Target Pair