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SMILES: CCOC(=O)c1ccc(Oc2nc(NC)nc(SC)n2)cc1

InChI Key: InChIKey=VHYIEBVKLNADOA-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 = 48915   
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))
BDBM48915
PNG
(4-(4-Methylamino-6-methylsulfanyl-[1,3,5]triazin-2...)
Show SMILES CCOC(=O)c1ccc(Oc2nc(NC)nc(SC)n2)cc1
Show InChI InChI=1S/C14H16N4O3S/c1-4-20-11(19)9-5-7-10(8-6-9)21-13-16-12(15-2)17-14(18-13)22-3/h5-8H,4H2,1-3H3,(H,15,16,17,18)
PDB

KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/an/an/a 0.00918n/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))
BDBM48915
PNG
(4-(4-Methylamino-6-methylsulfanyl-[1,3,5]triazin-2...)
Show SMILES CCOC(=O)c1ccc(Oc2nc(NC)nc(SC)n2)cc1
Show InChI InChI=1S/C14H16N4O3S/c1-4-20-11(19)9-5-7-10(8-6-9)21-13-16-12(15-2)17-14(18-13)22-3/h5-8H,4H2,1-3H3,(H,15,16,17,18)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/an/an/a 0.0174n/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