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BDBM62391 5-(2-chlorophenyl)-N-(2-ethyl-6-methyl-phenyl)-2-furamide::5-(2-chlorophenyl)-N-(2-ethyl-6-methyl-phenyl)furan-2-carboxamide::5-(2-chlorophenyl)-N-(2-ethyl-6-methylphenyl)-2-furancarboxamide::5-(2-chlorophenyl)-N-(2-ethyl-6-methylphenyl)furan-2-carboxamide::SR-02000000235::SR-02000000235-1::cid_7275219

SMILES: CCc1cccc(C)c1NC(=O)c1ccc(o1)-c1ccccc1Cl

InChI Key: InChIKey=ZRZCWLLLILAUDJ-UHFFFAOYSA-N

Data: 5 IC50

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 5 hits for monomerid = 62391   
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 4


(Homo sapiens (Human))
BDBM62391
PNG
(5-(2-chlorophenyl)-N-(2-ethyl-6-methyl-phenyl)-2-f...)
Show SMILES CCc1cccc(C)c1NC(=O)c1ccc(o1)-c1ccccc1Cl
Show InChI InChI=1S/C20H18ClNO2/c1-3-14-8-6-7-13(2)19(14)22-20(23)18-12-11-17(24-18)15-9-4-5-10-16(15)21/h4-12H,3H2,1-2H3,(H,22,23)
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n/an/a 269n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRISMC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q29K48P2
More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 3


(Homo sapiens (Human))
BDBM62391
PNG
(5-(2-chlorophenyl)-N-(2-ethyl-6-methyl-phenyl)-2-f...)
Show SMILES CCc1cccc(C)c1NC(=O)c1ccc(o1)-c1ccccc1Cl
Show InChI InChI=1S/C20H18ClNO2/c1-3-14-8-6-7-13(2)19(14)22-20(23)18-12-11-17(24-18)15-9-4-5-10-16(15)21/h4-12H,3H2,1-2H3,(H,22,23)
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n/an/a 2.50E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRISMC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2222S7B
More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 2


(Homo sapiens (Human))
BDBM62391
PNG
(5-(2-chlorophenyl)-N-(2-ethyl-6-methyl-phenyl)-2-f...)
Show SMILES CCc1cccc(C)c1NC(=O)c1ccc(o1)-c1ccccc1Cl
Show InChI InChI=1S/C20H18ClNO2/c1-3-14-8-6-7-13(2)19(14)22-20(23)18-12-11-17(24-18)15-9-4-5-10-16(15)21/h4-12H,3H2,1-2H3,(H,22,23)
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n/an/a>2.50E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRISMC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2J38QZW
More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 1


(Homo sapiens (Human))
BDBM62391
PNG
(5-(2-chlorophenyl)-N-(2-ethyl-6-methyl-phenyl)-2-f...)
Show SMILES CCc1cccc(C)c1NC(=O)c1ccc(o1)-c1ccccc1Cl
Show InChI InChI=1S/C20H18ClNO2/c1-3-14-8-6-7-13(2)19(14)22-20(23)18-12-11-17(24-18)15-9-4-5-10-16(15)21/h4-12H,3H2,1-2H3,(H,22,23)
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n/an/a>2.50E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRISMC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2SJ1J1Q
More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 5


(Homo sapiens (Human))
BDBM62391
PNG
(5-(2-chlorophenyl)-N-(2-ethyl-6-methyl-phenyl)-2-f...)
Show SMILES CCc1cccc(C)c1NC(=O)c1ccc(o1)-c1ccccc1Cl
Show InChI InChI=1S/C20H18ClNO2/c1-3-14-8-6-7-13(2)19(14)22-20(23)18-12-11-17(24-18)15-9-4-5-10-16(15)21/h4-12H,3H2,1-2H3,(H,22,23)
PDB

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KEGG

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UniChem

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n/an/a>2.50E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRISMC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2X928R1
More data for this
Ligand-Target Pair