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BDBM43797 1-[(4-methoxyphenyl)-phenyl-methyl]-3-[2-(3-prop-1-en-2-ylphenyl)propan-2-yl]urea::1-[(4-methoxyphenyl)-phenylmethyl]-3-[2-(3-prop-1-en-2-ylphenyl)propan-2-yl]urea::1-[(4-methoxyphenyl)-phenylmethyl]-3-[2-[3-(1-methylethenyl)phenyl]propan-2-yl]urea::1-[1-(3-isopropenylphenyl)-1-methyl-ethyl]-3-[(4-methoxyphenyl)-phenyl-methyl]urea::MLS-0214623.0001::cid_2901383

SMILES: COc1ccc(cc1)C(NC(=O)NC(C)(C)c1cccc(c1)C(C)=C)c1ccccc1

InChI Key: InChIKey=DFKHXDHGZOTQJE-UHFFFAOYSA-N

Data: 5 IC50  3 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 8 hits for monomerid = 43797   
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
Alkaline phosphatase, tissue-nonspecific isozyme


(Homo sapiens (Human))
BDBM43797
PNG
(1-[(4-methoxyphenyl)-phenyl-methyl]-3-[2-(3-prop-1...)
Show SMILES COc1ccc(cc1)C(NC(=O)NC(C)(C)c1cccc(c1)C(C)=C)c1ccccc1
Show InChI InChI=1S/C27H30N2O2/c1-19(2)22-12-9-13-23(18-22)27(3,4)29-26(30)28-25(20-10-7-6-8-11-20)21-14-16-24(31-5)17-15-21/h6-18,25H,1H2,2-5H3,(H2,28,29,30)
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n/an/an/an/a 6.62E+3n/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q20K26Z8
More data for this
Ligand-Target Pair
Alkaline phosphatase placental-like


(Homo sapiens (Human))
BDBM43797
PNG
(1-[(4-methoxyphenyl)-phenyl-methyl]-3-[2-(3-prop-1...)
Show SMILES COc1ccc(cc1)C(NC(=O)NC(C)(C)c1cccc(c1)C(C)=C)c1ccccc1
Show InChI InChI=1S/C27H30N2O2/c1-19(2)22-12-9-13-23(18-22)27(3,4)29-26(30)28-25(20-10-7-6-8-11-20)21-14-16-24(31-5)17-15-21/h6-18,25H,1H2,2-5H3,(H2,28,29,30)
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n/an/a>1.00E+5n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q29S1PG8
More data for this
Ligand-Target Pair
Alkaline phosphatase, tissue-nonspecific isozyme


(Homo sapiens (Human))
BDBM43797
PNG
(1-[(4-methoxyphenyl)-phenyl-methyl]-3-[2-(3-prop-1...)
Show SMILES COc1ccc(cc1)C(NC(=O)NC(C)(C)c1cccc(c1)C(C)=C)c1ccccc1
Show InChI InChI=1S/C27H30N2O2/c1-19(2)22-12-9-13-23(18-22)27(3,4)29-26(30)28-25(20-10-7-6-8-11-20)21-14-16-24(31-5)17-15-21/h6-18,25H,1H2,2-5H3,(H2,28,29,30)
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n/an/an/an/a 2.31E+4n/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q26Q1VPD
More data for this
Ligand-Target Pair
Alpi


(Rattus norvegicus (Rat))
BDBM43797
PNG
(1-[(4-methoxyphenyl)-phenyl-methyl]-3-[2-(3-prop-1...)
Show SMILES COc1ccc(cc1)C(NC(=O)NC(C)(C)c1cccc(c1)C(C)=C)c1ccccc1
Show InChI InChI=1S/C27H30N2O2/c1-19(2)22-12-9-13-23(18-22)27(3,4)29-26(30)28-25(20-10-7-6-8-11-20)21-14-16-24(31-5)17-15-21/h6-18,25H,1H2,2-5H3,(H2,28,29,30)
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n/an/a 7.54E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2DB809V
More data for this
Ligand-Target Pair
Intestinal alkaline phosphatase


(Homo sapiens (Human))
BDBM43797
PNG
(1-[(4-methoxyphenyl)-phenyl-methyl]-3-[2-(3-prop-1...)
Show SMILES COc1ccc(cc1)C(NC(=O)NC(C)(C)c1cccc(c1)C(C)=C)c1ccccc1
Show InChI InChI=1S/C27H30N2O2/c1-19(2)22-12-9-13-23(18-22)27(3,4)29-26(30)28-25(20-10-7-6-8-11-20)21-14-16-24(31-5)17-15-21/h6-18,25H,1H2,2-5H3,(H2,28,29,30)
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n/an/a 9.59E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute(SBMRI, San Diego, CA...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2X63KDM
More data for this
Ligand-Target Pair
Alkaline phosphatase placental-like


(Homo sapiens (Human))
BDBM43797
PNG
(1-[(4-methoxyphenyl)-phenyl-methyl]-3-[2-(3-prop-1...)
Show SMILES COc1ccc(cc1)C(NC(=O)NC(C)(C)c1cccc(c1)C(C)=C)c1ccccc1
Show InChI InChI=1S/C27H30N2O2/c1-19(2)22-12-9-13-23(18-22)27(3,4)29-26(30)28-25(20-10-7-6-8-11-20)21-14-16-24(31-5)17-15-21/h6-18,25H,1H2,2-5H3,(H2,28,29,30)
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n/an/a 1.32E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2NS0SCW
More data for this
Ligand-Target Pair
Alkaline phosphatase, tissue-nonspecific isozyme


(Homo sapiens (Human))
BDBM43797
PNG
(1-[(4-methoxyphenyl)-phenyl-methyl]-3-[2-(3-prop-1...)
Show SMILES COc1ccc(cc1)C(NC(=O)NC(C)(C)c1cccc(c1)C(C)=C)c1ccccc1
Show InChI InChI=1S/C27H30N2O2/c1-19(2)22-12-9-13-23(18-22)27(3,4)29-26(30)28-25(20-10-7-6-8-11-20)21-14-16-24(31-5)17-15-21/h6-18,25H,1H2,2-5H3,(H2,28,29,30)
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n/an/a 6.55E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2H130G1
More data for this
Ligand-Target Pair
Alkaline phosphatase, tissue-nonspecific isozyme


(Homo sapiens (Human))
BDBM43797
PNG
(1-[(4-methoxyphenyl)-phenyl-methyl]-3-[2-(3-prop-1...)
Show SMILES COc1ccc(cc1)C(NC(=O)NC(C)(C)c1cccc(c1)C(C)=C)c1ccccc1
Show InChI InChI=1S/C27H30N2O2/c1-19(2)22-12-9-13-23(18-22)27(3,4)29-26(30)28-25(20-10-7-6-8-11-20)21-14-16-24(31-5)17-15-21/h6-18,25H,1H2,2-5H3,(H2,28,29,30)
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n/an/an/an/a 3.32E+4n/an/an/an/a



Sanford-Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q2N58JTN
More data for this
Ligand-Target Pair