BDBM50115643 (+/-)-6 5-Methoxy-2-methyl-1,2,3,4,9,13b-hexahydro-2,4a-diaza-tribenzo[a,c,e]cycloheptene::CHEMBL324270
SMILES: COc1cccc2Cc3ccccc3C3CN(C)CCN3c12
InChI Key: InChIKey=GZXNMNCAWGIAAW-UHFFFAOYSA-N
Target/Host (Institution) | Ligand | Target/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 | pH | Temp °C |
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Serotonin receptor 2a and 2c (5HT2A and 5HT2C) (Rattus norvegicus (Rat)) | BDBM50115643 ((+/-)-6 5-Methoxy-2-methyl-1,2,3,4,9,13b-hexahydro...) | KEGG UniProtKB/SwissProt DrugBank GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | 0.210 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University Center for Pharmacy Curated by ChEMBL | Assay Description The binding affinity of the compound at 5-hydroxytryptamine 2C receptor was determined using [3H]-mesulergine | J Med Chem 45: 3280-5 (2002) BindingDB Entry DOI: 10.7270/Q28051ZZ | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
5-hydroxytryptamine receptor 2A (Rattus norvegicus (rat)) | BDBM50115643 ((+/-)-6 5-Methoxy-2-methyl-1,2,3,4,9,13b-hexahydro...) | PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | 0.700 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University Center for Pharmacy Curated by ChEMBL | Assay Description The binding affinity of the compound at 5-hydroxytryptamine 2A receptor was determined using [3H]-ketanserin | J Med Chem 45: 3280-5 (2002) BindingDB Entry DOI: 10.7270/Q28051ZZ | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
D(2) dopamine receptor (Rattus norvegicus (rat)) | BDBM50115643 ((+/-)-6 5-Methoxy-2-methyl-1,2,3,4,9,13b-hexahydro...) | PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | 28 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University Center for Pharmacy Curated by ChEMBL | Assay Description The binding affinity of the compound at the Dopamine receptor D2 determined using [3H]-spiperone | J Med Chem 45: 3280-5 (2002) BindingDB Entry DOI: 10.7270/Q28051ZZ | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
D(4) dopamine receptor (Homo sapiens (Human)) | BDBM50115643 ((+/-)-6 5-Methoxy-2-methyl-1,2,3,4,9,13b-hexahydro...) | Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | 92 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University Center for Pharmacy Curated by ChEMBL | Assay Description The binding affinity of the compound at the Dopamine receptor D4 determined using [3H]-YM-09151-2 | J Med Chem 45: 3280-5 (2002) BindingDB Entry DOI: 10.7270/Q28051ZZ | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
D(3) dopamine receptor (Homo sapiens (Human)) | BDBM50115643 ((+/-)-6 5-Methoxy-2-methyl-1,2,3,4,9,13b-hexahydro...) | PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | 260 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University Center for Pharmacy Curated by ChEMBL | Assay Description The binding affinity of the compound at the Dopamine receptor D3 determined using [3H]-spiperone | J Med Chem 45: 3280-5 (2002) BindingDB Entry DOI: 10.7270/Q28051ZZ | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
5-hydroxytryptamine receptor 1A (Homo sapiens (Human)) | BDBM50115643 ((+/-)-6 5-Methoxy-2-methyl-1,2,3,4,9,13b-hexahydro...) | PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | 345 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University Center for Pharmacy Curated by ChEMBL | Assay Description The binding affinity of the compound at the 5-hydroxytryptamine 1A receptor determined using [3H]-5-CT | J Med Chem 45: 3280-5 (2002) BindingDB Entry DOI: 10.7270/Q28051ZZ | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Serotonin 3a (5-HT3a)/3b (5-HT3b) receptor (Rattus norvegicus-RAT) | BDBM50115643 ((+/-)-6 5-Methoxy-2-methyl-1,2,3,4,9,13b-hexahydro...) | PDB UniProtKB/SwissProt GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | 2.90E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University Center for Pharmacy Curated by ChEMBL | Assay Description The binding affinity of the compound at 5-hydroxytryptamine 3 receptor was determined using [3H]-LY-278,584 | J Med Chem 45: 3280-5 (2002) BindingDB Entry DOI: 10.7270/Q28051ZZ | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Norepinephrine Monoamine transporters (Rattus norvegicus) | BDBM50115643 ((+/-)-6 5-Methoxy-2-methyl-1,2,3,4,9,13b-hexahydro...) | Reactome pathway KEGG UniProtKB/TrEMBL GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | n/a | n/a | 1.78E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University Center for Pharmacy Curated by ChEMBL | Assay Description The binding affinity of the compound at the Norepinephrin transpoter reputake sites determined using competition binding assay | J Med Chem 45: 3280-5 (2002) BindingDB Entry DOI: 10.7270/Q28051ZZ | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Sodium-dependent serotonin transporter (Rattus norvegicus (rat)) | BDBM50115643 ((+/-)-6 5-Methoxy-2-methyl-1,2,3,4,9,13b-hexahydro...) | PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | n/a | n/a | 2.90E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University Center for Pharmacy Curated by ChEMBL | Assay Description The binding affinity of the compound at the 5-HT reputake sites determined using competition binding assay | J Med Chem 45: 3280-5 (2002) BindingDB Entry DOI: 10.7270/Q28051ZZ | |||||||||||
More data for this Ligand-Target Pair |