BDBM50511257 CHEMBL4577693

SMILES CN1/C(=C/C=C/C=C/C2=[N+](CCCCCC(=O)NCC(=O)NCC(=O)NCC(=O)NCC(=O)NCCCNC(=N)Nc3ccc4[nH]c5c(c4c3)C[C@@]3(O)[C@H]4Cc6ccc(O)c7c6[C@@]3(CCN4CC3CC3)[C@H]5O7)c3ccc(S(=O)(=O)[O-])cc3C2(C)C)C(C)(C)c2cc(S(=O)(=O)O)ccc21

InChI Key InChIKey=HCVZFSVJQSJQAZ-UHFFFAOYSA-N

Data  3 KI  1 Kd

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50511257   

TargetKappa-type opioid receptor(Human)
Julius Maximilian University of W£Rzburg

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50511257BDBM50511257(CHEMBL4577693)
Affinity DataKi:  1.80nMAssay Description:Displacement of [3H]-diprenorphine from recombinant human KOR transiently expressed in HEK293 cell membranes measured after 60 minsMore data for this Ligand-Target Pair
In Depth
Date in BDB:
2/20/2021
Entry Details Article
PubMed
TargetKappa-type opioid receptor(Human)
Julius Maximilian University of W£Rzburg

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50511257BDBM50511257(CHEMBL4577693)
Affinity DataKd:  4.80nMAssay Description:Binding affinity to recombinant human KOR transiently expressed in CHOK1 cells measured after 20 mins by TIRF microscopic analysisMore data for this Ligand-Target Pair
In Depth
Date in BDB:
2/20/2021
Entry Details Article
PubMed
TargetMu-type opioid receptor(Human)
Julius Maximilian University of W£Rzburg

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50511257BDBM50511257(CHEMBL4577693)
Affinity DataKi:  133nMAssay Description:Displacement of [3H]-diprenorphine from recombinant human MOR transiently expressed in HEK293 cell membranes measured after 60 minsMore data for this Ligand-Target Pair
In Depth
Date in BDB:
2/20/2021
Entry Details Article
PubMed
TargetDelta-type opioid receptor(Human)
Julius Maximilian University of W£Rzburg

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50511257BDBM50511257(CHEMBL4577693)
Affinity DataKi:  193nMAssay Description:Displacement of [3H]-diprenorphine from recombinant human DOR transiently expressed in HEK293 cell membranes measured after 60 minsMore data for this Ligand-Target Pair
In Depth
Date in BDB:
2/20/2021
Entry Details Article
PubMed