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SMILES: CCOC(=O)c1sc(NC(=O)COC(=O)Cn2cnc3ccccc23)c(C(=O)OCC)c1C

InChI Key: InChIKey=DHOMMKDFCLFIQX-UHFFFAOYSA-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 = 48933   
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))
BDBM48933
PNG
(5-[[2-[2-(1-benzimidazolyl)-1-oxoethoxy]-1-oxoethy...)
Show SMILES CCOC(=O)c1sc(NC(=O)COC(=O)Cn2cnc3ccccc23)c(C(=O)OCC)c1C
Show InChI InChI=1S/C22H23N3O7S/c1-4-30-21(28)18-13(3)19(22(29)31-5-2)33-20(18)24-16(26)11-32-17(27)10-25-12-23-14-8-6-7-9-15(14)25/h6-9,12H,4-5,10-11H2,1-3H3,(H,24,26)
PDB

KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/an/an/a 0.00966n/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
D(1B) dopamine receptor


(Homo sapiens (Human))
BDBM48933
PNG
(5-[[2-[2-(1-benzimidazolyl)-1-oxoethoxy]-1-oxoethy...)
Show SMILES CCOC(=O)c1sc(NC(=O)COC(=O)Cn2cnc3ccccc23)c(C(=O)OCC)c1C
Show InChI InChI=1S/C22H23N3O7S/c1-4-30-21(28)18-13(3)19(22(29)31-5-2)33-20(18)24-16(26)11-32-17(27)10-25-12-23-14-8-6-7-9-15(14)25/h6-9,12H,4-5,10-11H2,1-3H3,(H,24,26)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/an/an/a 0.0103n/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/Q2MW2FJG
More data for this
Ligand-Target Pair