BDBM50292538 (3aS,8aR)-1,3a,8-trimethyl-1,2,3,3a,8,8a-hexahydropyrrolo[2,3-b]indol-5-ol::CHEMBL310934::eseroline
SMILES: CN1CC[C@]2(C)[C@H]1N(C)c1ccc(O)cc21
InChI Key: InChIKey=HKGWQUVGHPDEBZ-OLZOCXBDSA-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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Opioid receptors; mu & delta (Rattus norvegicus (rat)) | BDBM50292538 ((3aS,8aR)-1,3a,8-trimethyl-1,2,3,3a,8,8a-hexahydro...) | PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet | Purchase CHEMBL PC cid PC sid UniChem Patents Similars | Article PubMed | n/a | n/a | 1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA Curated by ChEMBL | Assay Description Displacement of [3H]pCl-DPDP from delta opioid receptor in rat central nervous system membrane | J Nat Prod 55: 380-384 (1992) Article DOI: 10.1021/np50081a017 BindingDB Entry DOI: 10.7270/Q28W3DBN | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Steroid Delta-isomerase (Pseudomonas putida) | BDBM50292538 ((3aS,8aR)-1,3a,8-trimethyl-1,2,3,3a,8,8a-hexahydro...) | PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet | Purchase CHEMBL PC cid PC sid UniChem Patents Similars | Article PubMed | n/a | n/a | n/a | 1.80E+5 | n/a | n/a | n/a | n/a | n/a |
The University of Tokyo Curated by ChEMBL | Assay Description Binding affinity to Pseudomonas putida KSI by isothermal titration calorimetry | J Med Chem 56: 2155-9 (2013) Article DOI: 10.1021/jm301603n BindingDB Entry DOI: 10.7270/Q2PR7X98 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Mu-type opioid receptor (Rattus norvegicus (rat)) | BDBM50292538 ((3aS,8aR)-1,3a,8-trimethyl-1,2,3,3a,8,8a-hexahydro...) | PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet | Purchase CHEMBL PC cid PC sid UniChem Patents Similars | Article PubMed | n/a | n/a | 300 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA Curated by ChEMBL | Assay Description Displacement of [3H]DAMGO from mu opioid receptor in rat central nervous system membrane | J Nat Prod 55: 380-384 (1992) Article DOI: 10.1021/np50081a017 BindingDB Entry DOI: 10.7270/Q28W3DBN | |||||||||||
More data for this Ligand-Target Pair |