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BDBM50202316 1-ethyl-2,3,12,12a-tetrahydro-1H-7-oxa-1-aza-pleiaden-10-ol::CHEMBL154468

SMILES: CCN1CCc2cccc3Oc4ccc(O)cc4CC1c23

InChI Key: InChIKey=WDBUJQKFRINDKP-UHFFFAOYSA-N

Data: 4 KI

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50202316   
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
D(1A) dopamine receptor


(RAT)
BDBM50202316
PNG
(1-ethyl-2,3,12,12a-tetrahydro-1H-7-oxa-1-aza-pleia...)
Show SMILES CCN1CCc2cccc3Oc4ccc(O)cc4CC1c23
Show InChI InChI=1S/C18H19NO2/c1-2-19-9-8-12-4-3-5-17-18(12)15(19)11-13-10-14(20)6-7-16(13)21-17/h3-7,10,15,20H,2,8-9,11H2,1H3
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
6.76E+3n/an/an/an/an/an/an/an/a



Universit£ di Camerino

Curated by ChEMBL


Assay Description
Binding Affinity was determined against Dopamine receptor D1 in rat striatal membranes using [3H]- SCH 23390 radioligand.


J Med Chem 43: 599-608 (2000)


Article DOI: 10.1021/jm991034o
BindingDB Entry DOI: 10.7270/Q2X35161
More data for this
Ligand-Target Pair
D(1A) dopamine receptor


(RAT)
BDBM50202316
PNG
(1-ethyl-2,3,12,12a-tetrahydro-1H-7-oxa-1-aza-pleia...)
Show SMILES CCN1CCc2cccc3Oc4ccc(O)cc4CC1c23
Show InChI InChI=1S/C18H19NO2/c1-2-19-9-8-12-4-3-5-17-18(12)15(19)11-13-10-14(20)6-7-16(13)21-17/h3-7,10,15,20H,2,8-9,11H2,1H3
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
6.80E+3n/an/an/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Displacement of [3H]SCH-23390 from rat dopamine D1 receptor


J Med Chem 50: 171-81 (2007)


Article DOI: 10.1021/jm060959i
BindingDB Entry DOI: 10.7270/Q22J6CPJ
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Rattus norvegicus (rat))
BDBM50202316
PNG
(1-ethyl-2,3,12,12a-tetrahydro-1H-7-oxa-1-aza-pleia...)
Show SMILES CCN1CCc2cccc3Oc4ccc(O)cc4CC1c23
Show InChI InChI=1S/C18H19NO2/c1-2-19-9-8-12-4-3-5-17-18(12)15(19)11-13-10-14(20)6-7-16(13)21-17/h3-7,10,15,20H,2,8-9,11H2,1H3
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
<1.00E+4n/an/an/an/an/an/an/an/a



Universit£ di Camerino

Curated by ChEMBL


Assay Description
Binding Affinity was determined against Dopamine receptor D2 in rat striatal membranes using [3H]- spiperone radioligand.


J Med Chem 43: 599-608 (2000)


Article DOI: 10.1021/jm991034o
BindingDB Entry DOI: 10.7270/Q2X35161
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Rattus norvegicus (rat))
BDBM50202316
PNG
(1-ethyl-2,3,12,12a-tetrahydro-1H-7-oxa-1-aza-pleia...)
Show SMILES CCN1CCc2cccc3Oc4ccc(O)cc4CC1c23
Show InChI InChI=1S/C18H19NO2/c1-2-19-9-8-12-4-3-5-17-18(12)15(19)11-13-10-14(20)6-7-16(13)21-17/h3-7,10,15,20H,2,8-9,11H2,1H3
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Displacement of [3H]raclopride from rat dopamine D2 receptor


J Med Chem 50: 171-81 (2007)


Article DOI: 10.1021/jm060959i
BindingDB Entry DOI: 10.7270/Q22J6CPJ
More data for this
Ligand-Target Pair