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4 similar compounds to monomer 50089150

Compile data set for download or QSAR
Wt: 185.2
BDBM50018546
Wt: 337.4
BDBM50089145
Wt: 261.3
BDBM50089147
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Wt: 227.3
BDBM50421899

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 7 hits for monomerid = 50018546,50089145,50089147,50421899   
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
Histamine H1 receptor


(RAT)
BDBM50089147
PNG
(2-Methyl-9-phenyl-2,3,4,9-tetrahydro-1H-indeno[2,1...)
Show SMILES CN1CCC2=C(C1)C(c1ccccc21)c1ccccc1
Show InChI InChI=1/C19H19N/c1-20-12-11-16-15-9-5-6-10-17(15)19(18(16)13-20)14-7-3-2-4-8-14/h2-10,19H,11-13H2,1H3
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PubMed
20n/an/an/an/an/an/an/an/a



TBA

Curated by PDSP Ki Database




Proc Natl Acad Sci U S A 75: 6290-4 (1978)


Article DOI: 10.1073/pnas.75.12.6290
BindingDB Entry DOI: 10.7270/Q2FN14P6
More data for this
Ligand-Target Pair
Monoamine oxidase


(Bos taurus)
BDBM50018546
PNG
(2-Methyl-2,3,4,9-tetrahydro-1H-indeno[2,1-c]pyridi...)
Show SMILES CN1CCC2=C(Cc3ccccc23)C1
Show InChI InChI=1S/C13H15N/c1-14-7-6-13-11(9-14)8-10-4-2-3-5-12(10)13/h2-5H,6-9H2,1H3
PDB
MMDB

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B.MOAD
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Article
PubMed
7.50E+4n/an/an/an/an/an/an/an/a



University of California

Curated by ChEMBL


Assay Description
Binding affinity of the compound was tested against Monoamine oxidase B


J Med Chem 32: 473-7 (1989)


Article DOI: 10.1021/jm00122a031
BindingDB Entry DOI: 10.7270/Q2RR1X7Q
More data for this
Ligand-Target Pair
Sigma non-opioid intracellular receptor 1


(Homo sapiens (Human))
BDBM50421899
PNG
(CHEMBL545688)
Show SMILES CCCCN1CCC2=C(Cc3ccccc23)C1
Show InChI InChI=1S/C16H21N/c1-2-3-9-17-10-8-16-14(12-17)11-13-6-4-5-7-15(13)16/h4-7H,2-3,8-12H2,1H3
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Article
PubMed
n/an/a 1.90n/an/an/an/an/an/a



Merck Sharp and Dohme Research Laboratories

Curated by ChEMBL


Assay Description
In vitro for the binding affinity against sigma receptor by using [3H]DTG as radioligand in guinea pig cerebellum


J Med Chem 35: 2025-33 (1992)


Article DOI: 10.1021/jm00089a012
BindingDB Entry DOI: 10.7270/Q2MP54K8
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50421899
PNG
(CHEMBL545688)
Show SMILES CCCCN1CCC2=C(Cc3ccccc23)C1
Show InChI InChI=1S/C16H21N/c1-2-3-9-17-10-8-16-14(12-17)11-13-6-4-5-7-15(13)16/h4-7H,2-3,8-12H2,1H3
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n/an/a 60n/an/an/an/an/an/a



Merck Sharp and Dohme Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of [3H](-)-sulpiride binding to rat striatum dopamine receptor D2


J Med Chem 35: 2025-33 (1992)


Article DOI: 10.1021/jm00089a012
BindingDB Entry DOI: 10.7270/Q2MP54K8
More data for this
Ligand-Target Pair
Histamine H1 receptor


(Cavia porcellus (domestic guinea pig))
BDBM50089147
PNG
(2-Methyl-9-phenyl-2,3,4,9-tetrahydro-1H-indeno[2,1...)
Show SMILES CN1CCC2=C(C1)C(c1ccccc21)c1ccccc1
Show InChI InChI=1/C19H19N/c1-20-12-11-16-15-9-5-6-10-17(15)19(18(16)13-20)14-7-3-2-4-8-14/h2-10,19H,11-13H2,1H3
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n/an/an/a 1.58n/an/an/an/an/a



Vrije Universiteit

Curated by ChEMBL


Assay Description
Potency against histamine H1 receptor on guinea pig ileum


J Med Chem 38: 3351-60 (1995)


Article DOI: 10.1021/jm00017a019
BindingDB Entry DOI: 10.7270/Q2ZW1N49
More data for this
Ligand-Target Pair
Histamine H1 receptor


(Cavia porcellus (domestic guinea pig))
BDBM50089145
PNG
(2-Benzyl-9-phenyl-2,3,4,9-tetrahydro-1H-indeno[2,1...)
Show SMILES C(N1CCC2=C(C1)C(c1ccccc21)c1ccccc1)c1ccccc1
Show InChI InChI=1/C25H23N/c1-3-9-19(10-4-1)17-26-16-15-22-21-13-7-8-14-23(21)25(24(22)18-26)20-11-5-2-6-12-20/h1-14,25H,15-18H2
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n/an/a 470n/an/an/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
In vitro antagonistic activity at the Histamine H1 receptor in guinea pig ileum


Bioorg Med Chem Lett 10: 1277-9 (2000)


Article DOI: 10.1016/s0960-894x(00)00199-2
BindingDB Entry DOI: 10.7270/Q2T152VB
More data for this
Ligand-Target Pair
Histamine H1 receptor


(Cavia porcellus (domestic guinea pig))
BDBM50089147
PNG
(2-Methyl-9-phenyl-2,3,4,9-tetrahydro-1H-indeno[2,1...)
Show SMILES CN1CCC2=C(C1)C(c1ccccc21)c1ccccc1
Show InChI InChI=1/C19H19N/c1-20-12-11-16-15-9-5-6-10-17(15)19(18(16)13-20)14-7-3-2-4-8-14/h2-10,19H,11-13H2,1H3
UniProtKB/SwissProt

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PC sid
UniChem

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Article
PubMed
n/an/a 36n/an/an/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
In vitro antagonistic activity at the Histamine H1 receptor in guinea pig ileum


Bioorg Med Chem Lett 10: 1277-9 (2000)


Article DOI: 10.1016/s0960-894x(00)00199-2
BindingDB Entry DOI: 10.7270/Q2T152VB
More data for this
Ligand-Target Pair