BDBM50034347 (3aS,9aR)-1-(cyclopropylmethyl)-5-methoxy-2,3,3a,4,9,9a-hexahydro-1H-benzo[f]indole::(3aS,9aR)-1-Cyclopropylmethyl-5-methoxy-2,3,3a,4,9,9a-hexahydro-1H-benzo[f]indole::1-Cyclopropylmethyl-5-methoxy-2,3,3a,4,9,9a-hexahydro-1H-benzo[f]indole::CHEMBL267769
SMILES: COc1cccc2C[C@@H]3[C@H](CCN3CC3CC3)Cc12
InChI Key: InChIKey=ZZPRPPYBWAPLEI-GDBMZVCRSA-N
Data: 3 KI
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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
5-hydroxytryptamine receptor 1A (Homo sapiens (Human)) | BDBM50034347 ((3aS,9aR)-1-(cyclopropylmethyl)-5-methoxy-2,3,3a,4...) | PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | 29 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Arris Pharmaceutical Corporation Curated by ChEMBL | Assay Description Tested for activity against 5-hydroxytryptamine 1A receptor from bovine hippocampus | J Med Chem 38: 1295-308 (1995) BindingDB Entry DOI: 10.7270/Q2CJ8CJ9 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
5-hydroxytryptamine receptor 1A (Homo sapiens (Human)) | BDBM50034347 ((3aS,9aR)-1-(cyclopropylmethyl)-5-methoxy-2,3,3a,4...) | PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | 29 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Upjohn Laboratories Curated by ChEMBL | Assay Description Binding affinity against [3H]8-OH-DPAT-labeled 5-hydroxytryptamine 1A receptor sites in bovine hippocampus | J Med Chem 36: 1069-83 (1993) BindingDB Entry DOI: 10.7270/Q2833SPR | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
D(2) dopamine receptor (Rattus norvegicus (rat)) | BDBM50034347 ((3aS,9aR)-1-(cyclopropylmethyl)-5-methoxy-2,3,3a,4...) | PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | >1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Upjohn Laboratories Curated by ChEMBL | Assay Description Compound was evaluated for the binding affinity against [3H]raclopride-labeled dopamine receptor D2 in rat striatum | J Med Chem 36: 1069-83 (1993) BindingDB Entry DOI: 10.7270/Q2833SPR | |||||||||||
More data for this Ligand-Target Pair |