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BDBM49038 MLS000057474::N-(2-furanylmethyl)-4-oxo-3-phenyl-1-phthalazinecarboxamide::N-(2-furfuryl)-4-keto-3-phenyl-phthalazine-1-carboxamide::N-(furan-2-ylmethyl)-4-oxidanylidene-3-phenyl-phthalazine-1-carboxamide::N-(furan-2-ylmethyl)-4-oxo-3-phenylphthalazine-1-carboxamide::SMR000064105::cid_2085773

SMILES: O=C(NCc1ccco1)c1nn(-c2ccccc2)c(=O)c2ccccc12

InChI Key: InChIKey=MPKHYSYXZMIPPL-UHFFFAOYSA-N

Data: 2 IC50  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 3 hits for monomerid = 49038   
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))
BDBM49038
PNG
(MLS000057474 | N-(2-furanylmethyl)-4-oxo-3-phenyl-...)
Show SMILES O=C(NCc1ccco1)c1nn(-c2ccccc2)c(=O)c2ccccc12
Show InChI InChI=1S/C20H15N3O3/c24-19(21-13-15-9-6-12-26-15)18-16-10-4-5-11-17(16)20(25)23(22-18)14-7-2-1-3-8-14/h1-12H,13H2,(H,21,24)
PDB

KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
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PC cid
PC sid
UniChem
PCBioAssay
n/an/an/an/a 0.0567n/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
Alpha trans-inducing protein (VP16)


(Human herpesvirus 1 (strain 17) (HHV-1) (Human her...)
BDBM49038
PNG
(MLS000057474 | N-(2-furanylmethyl)-4-oxo-3-phenyl-...)
Show SMILES O=C(NCc1ccco1)c1nn(-c2ccccc2)c(=O)c2ccccc12
Show InChI InChI=1S/C20H15N3O3/c24-19(21-13-15-9-6-12-26-15)18-16-10-4-5-11-17(16)20(25)23(22-18)14-7-2-1-3-8-14/h1-12H,13H2,(H,21,24)
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem
PCBioAssay
n/an/a>3.59E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay




PubChem Bioassay (2013)


BindingDB Entry DOI: 10.7270/Q2SX6BVP
More data for this
Ligand-Target Pair
nuclear receptor subfamily 5 group A member 2 isoform 2


(Homo sapiens (Human))
BDBM49038
PNG
(MLS000057474 | N-(2-furanylmethyl)-4-oxo-3-phenyl-...)
Show SMILES O=C(NCc1ccco1)c1nn(-c2ccccc2)c(=O)c2ccccc12
Show InChI InChI=1S/C20H15N3O3/c24-19(21-13-15-9-6-12-26-15)18-16-10-4-5-11-17(16)20(25)23(22-18)14-7-2-1-3-8-14/h1-12H,13H2,(H,21,24)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem
PCBioAssay
n/an/a>3.59E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay




PubChem Bioassay (2013)


BindingDB Entry DOI: 10.7270/Q22F7M18
More data for this
Ligand-Target Pair