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BDBM41721 1-[2-[1-(2-furanylmethyl)-2,5-dimethyl-3-pyrrolyl]-2-oxoethyl]-3-(phenylmethyl)imidazolidine-2,4,5-trione::1-[2-[1-(furan-2-ylmethyl)-2,5-dimethyl-pyrrol-3-yl]-2-oxidanylidene-ethyl]-3-(phenylmethyl)imidazolidine-2,4,5-trione::1-benzyl-3-[2-[1-(2-furfuryl)-2,5-dimethyl-pyrrol-3-yl]-2-keto-ethyl]imidazolidine-2,4,5-trione::1-benzyl-3-[2-[1-(furan-2-ylmethyl)-2,5-dimethylpyrrol-3-yl]-2-oxoethyl]imidazolidine-2,4,5-trione::SR-01000759120-1::cid_7819712

SMILES: Cc1cc(C(=O)CN2C(=O)N(Cc3ccccc3)C(=O)C2=O)c(C)n1Cc1ccco1

InChI Key: InChIKey=VILLGTBHNOZGOJ-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 = 41721   
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
Sphingosine 1-phosphate receptor 2


(Homo sapiens (Human))
BDBM41721
PNG
(1-[2-[1-(2-furanylmethyl)-2,5-dimethyl-3-pyrrolyl]...)
Show SMILES Cc1cc(C(=O)CN2C(=O)N(Cc3ccccc3)C(=O)C2=O)c(C)n1Cc1ccco1
Show InChI InChI=1S/C23H21N3O5/c1-15-11-19(16(2)24(15)13-18-9-6-10-31-18)20(27)14-26-22(29)21(28)25(23(26)30)12-17-7-4-3-5-8-17/h3-11H,12-14H2,1-2H3
PDB

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KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

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PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/an/an/a>4.40E+4n/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLSCN Center Name): The Scripps Research Institute Molecular Screening Center Center Affiliation: The Scripps Research Institute (TSRI) Assay...


PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q2RX99HM
More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 2


(Homo sapiens (Human))
BDBM41721
PNG
(1-[2-[1-(2-furanylmethyl)-2,5-dimethyl-3-pyrrolyl]...)
Show SMILES Cc1cc(C(=O)CN2C(=O)N(Cc3ccccc3)C(=O)C2=O)c(C)n1Cc1ccco1
Show InChI InChI=1S/C23H21N3O5/c1-15-11-19(16(2)24(15)13-18-9-6-10-31-18)20(27)14-26-22(29)21(28)25(23(26)30)12-17-7-4-3-5-8-17/h3-11H,12-14H2,1-2H3
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/an/an/a>3.00E+4n/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLSCN Center Name): The Scripps Research Institute Molecular Screening Center Center Affiliation: The Scripps Research Institute (TSRI) Assay...


PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q22R3Q2J
More data for this
Ligand-Target Pair