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BDBM48909 2-[5-(4-Fluoro-phenyl)-thiazolo[2,3-c][1,2,4]triazol-3-ylsulfanyl]-N-furan-2-ylmethyl-acetamide::2-[[5-(4-fluorophenyl)-3-thiazolo[2,3-c][1,2,4]triazolyl]thio]-N-(2-furanylmethyl)acetamide::2-[[5-(4-fluorophenyl)-[1,3]thiazolo[2,3-c][1,2,4]triazol-3-yl]sulfanyl]-N-(furan-2-ylmethyl)acetamide::2-[[5-(4-fluorophenyl)-[1,3]thiazolo[2,3-c][1,2,4]triazol-3-yl]sulfanyl]-N-(furan-2-ylmethyl)ethanamide::2-[[5-(4-fluorophenyl)thiazolo[2,3-c][1,2,4]triazol-3-yl]thio]-N-(2-furfuryl)acetamide::MLS000068421::SMR000007125::cid_649740

SMILES: Fc1ccc(cc1)-c1csc2nnc(SCC(=O)NCc3ccco3)n12

InChI Key: InChIKey=YLHPNUNGAPWAMU-UHFFFAOYSA-N

Data: 2 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 2 hits for monomerid = 48909   
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))
BDBM48909
PNG
(2-[5-(4-Fluoro-phenyl)-thiazolo[2,3-c][1,2,4]triaz...)
Show SMILES Fc1ccc(cc1)-c1csc2nnc(SCC(=O)NCc3ccco3)n12
Show InChI InChI=1S/C17H13FN4O2S2/c18-12-5-3-11(4-6-12)14-9-25-16-20-21-17(22(14)16)26-10-15(23)19-8-13-2-1-7-24-13/h1-7,9H,8,10H2,(H,19,23)
PDB

KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
PCBioAssay
n/an/an/an/a 0.0101n/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))
BDBM48909
PNG
(2-[5-(4-Fluoro-phenyl)-thiazolo[2,3-c][1,2,4]triaz...)
Show SMILES Fc1ccc(cc1)-c1csc2nnc(SCC(=O)NCc3ccco3)n12
Show InChI InChI=1S/C17H13FN4O2S2/c18-12-5-3-11(4-6-12)14-9-25-16-20-21-17(22(14)16)26-10-15(23)19-8-13-2-1-7-24-13/h1-7,9H,8,10H2,(H,19,23)
UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
PCBioAssay
n/an/an/an/a 0.00680n/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