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4 similar compounds to monomer 50156200

Compile data set for download or QSAR
Wt: 269.4
BDBM50016920
Wt: 367.5
BDBM50041256
Wt: 546.5
BDBM50156209
Wt: 408.5
BDBM50195812

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 6 hits for monomerid = 50016920,50041256,50156209,50195812   
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
Sigma non-opioid intracellular receptor 1


(Homo sapiens (Human))
BDBM50041256
PNG
(CHEMBL19985 | Methyl-bis-(3-naphthalen-2-yl-propyl...)
Show SMILES CN(CCCc1ccc2ccccc2c1)CCCc1ccc2ccccc2c1
Show InChI InChI=1S/C27H29N/c1-28(18-6-8-22-14-16-24-10-2-4-12-26(24)20-22)19-7-9-23-15-17-25-11-3-5-13-27(25)21-23/h2-5,10-17,20-21H,6-9,18-19H2,1H3
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Article
PubMed
30n/an/an/an/an/an/an/an/a



Virginia Commonwealth University

Curated by ChEMBL


Assay Description
Binding affinity against sigma-1 receptor of guinea pig brain membranes using [3H]-pentazocine as radioligand


J Med Chem 37: 1214-9 (1994)


Article DOI: 10.1021/jm00034a020
BindingDB Entry DOI: 10.7270/Q29P30QV
More data for this
Ligand-Target Pair
Serotonin (5-HT) receptor


(Rattus norvegicus (rat))
BDBM50016920
PNG
(Butyl-ethyl-(3-naphthalen-1-yl-propyl)-amine | CHE...)
Show SMILES CCCCN(CC)CCCc1cccc2ccccc12
Show InChI InChI=1S/C19H27N/c1-3-5-15-20(4-2)16-9-13-18-12-8-11-17-10-6-7-14-19(17)18/h6-8,10-12,14H,3-5,9,13,15-16H2,1-2H3
KEGG

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300n/an/an/an/an/an/an/an/a



Virginia Commonwealth University

Curated by ChEMBL


Assay Description
Inhibitory activity against 5-hydroxytryptamine 1A receptor of rat hippocampal tissue using [3H]OH-DPAT as radioligand.


J Med Chem 32: 859-63 (1989)


Article DOI: 10.1021/jm00124a021
BindingDB Entry DOI: 10.7270/Q2571CMK
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Homo sapiens (Human))
BDBM50195812
PNG
(CHEMBL3818689)
Show SMILES COc1ccc(\C=C\C(=O)NCCC2CCN(Cc3ccccc3)CC2)cc1OC
Show InChI InChI=1S/C25H32N2O3/c1-29-23-10-8-21(18-24(23)30-2)9-11-25(28)26-15-12-20-13-16-27(17-14-20)19-22-6-4-3-5-7-22/h3-11,18,20H,12-17,19H2,1-2H3,(H,26,28)/b11-9+
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n/an/a 260n/an/an/an/an/an/a



Instituto de Qu£mica M£dica

Curated by ChEMBL


Assay Description
Inhibition of human recombinant AChE using acetylthiocholine iodide as substrate preincubated for 5 mins followed by substrate addition measured for ...


Eur J Med Chem 121: 376-386 (2016)


Article DOI: 10.1016/j.ejmech.2016.05.055
BindingDB Entry DOI: 10.7270/Q2HX1FNV
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))
BDBM50195812
PNG
(CHEMBL3818689)
Show SMILES COc1ccc(\C=C\C(=O)NCCC2CCN(Cc3ccccc3)CC2)cc1OC
Show InChI InChI=1S/C25H32N2O3/c1-29-23-10-8-21(18-24(23)30-2)9-11-25(28)26-15-12-20-13-16-27(17-14-20)19-22-6-4-3-5-7-22/h3-11,18,20H,12-17,19H2,1-2H3,(H,26,28)/b11-9+
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n/an/a>1.00E+5n/an/an/an/an/an/a



Instituto de Qu£mica M£dica

Curated by ChEMBL


Assay Description
Inhibition of human recombinant MAOA using p-tyramine as substrate incubated for 15 mins by fluorimetric method


Eur J Med Chem 121: 376-386 (2016)


Article DOI: 10.1016/j.ejmech.2016.05.055
BindingDB Entry DOI: 10.7270/Q2HX1FNV
More data for this
Ligand-Target Pair
Cholinesterase


(Homo sapiens (Human))
BDBM50195812
PNG
(CHEMBL3818689)
Show SMILES COc1ccc(\C=C\C(=O)NCCC2CCN(Cc3ccccc3)CC2)cc1OC
Show InChI InChI=1S/C25H32N2O3/c1-29-23-10-8-21(18-24(23)30-2)9-11-25(28)26-15-12-20-13-16-27(17-14-20)19-22-6-4-3-5-7-22/h3-11,18,20H,12-17,19H2,1-2H3,(H,26,28)/b11-9+
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n/an/a 690n/an/an/an/an/an/a



Instituto de Qu£mica M£dica

Curated by ChEMBL


Assay Description
Inhibition of human serum BuChE using butyrylthiocholine as substrate preincubated for 5 mins followed by substrate addition measured for 5 mins by E...


Eur J Med Chem 121: 376-386 (2016)


Article DOI: 10.1016/j.ejmech.2016.05.055
BindingDB Entry DOI: 10.7270/Q2HX1FNV
More data for this
Ligand-Target Pair
5-Hydroxytryptamine receptor 6 (5-HT6)


(Homo sapiens (Human))
BDBM50156209
PNG
(CHEMBL3780579)
Show SMILES COc1ccc(cc1N1CCN(C)CC1)S(=O)(=O)NCC(C)(C)c1cccc2ccc(Br)cc12
Show InChI InChI=1S/C26H32BrN3O3S/c1-26(2,23-7-5-6-19-8-9-20(27)16-22(19)23)18-28-34(31,32)21-10-11-25(33-4)24(17-21)30-14-12-29(3)13-15-30/h5-11,16-17,28H,12-15,18H2,1-4H3
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n/an/a 0.310n/an/an/an/an/an/a



Temple University

Curated by ChEMBL


Assay Description
Displacement of [3H]LSD from human 5-HT6 receptor expressed in CHO cell membranes after 120 mins by liquid scintillation counting method


ACS Med Chem Lett 7: 12-4 (2016)


Article DOI: 10.1021/acsmedchemlett.5b00466
BindingDB Entry DOI: 10.7270/Q2Z89F8F
More data for this
Ligand-Target Pair