BDBM50002373 1-(1-ethynyl)-15a,17a-dimethyl-(1R,15aS,17aS)-2,3,3a,3b,4,5,5a,6,15,15a,15b,16,17,17a-tetradecahydro-1H-benzo[4,5]imidazo[2,1-b]cyclopenta[5,6]naphtho[1,2-g]quinazolin-1-ol::1-(1-ethynyl)-15a,17a-dimethyl-(1R,15aS,17aS)-2,3,3a,3b,4,5,5a,6,15,15a,15b,16,17,17a-tetradecahydro-1H-benzo[4,5]imidazo[2,1-b]cyclopenta[5,6]naphtho[1,2-g]quinazolin-1-ol(0.2MH2O)::1-(1-ethynyl)-15a,17a-dimethyl-(1R,15aS,17aS)-2,3,3a,3b,4,5,5a,6,15,15a,15b,16,17,17a-tetradecahydro-1H-benzo[4,5]imidazo[2,1-b]cyclopenta[5,6]naphtho[1,2-g]quinazolin-1-ol(0.7MH2O)::CHEMBL333069

SMILES C[C@]12CCC3C(CCC4Cc5nc6nc7ccccc7n6cc5C[C@]34C)C1CC[C@@]2(O)C#C

InChI Key InChIKey=AIIXYCDTEGICEE-CTVCDRHFSA-N

Data  3 IC50

  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 3 hits for monomerid = 50002373   

TargetSubstance-P receptor(Rattus norvegicus (rat))
Rochester

Curated by ChEMBL
LigandPNGBDBM50002373(1-(1-ethynyl)-15a,17a-dimethyl-(1R,15aS,17aS)-2,3,...)
Affinity DataIC50:  48nMAssay Description:Inhibition of [125]I-Bolton Hunter Substance P([125]I-BHSP) binding to standard Tachykinin receptor 1 from rat forebrain membranes.More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetSubstance-P receptor(Rattus norvegicus (rat))
Rochester

Curated by ChEMBL
LigandPNGBDBM50002373(1-(1-ethynyl)-15a,17a-dimethyl-(1R,15aS,17aS)-2,3,...)
Affinity DataIC50:  24nMAssay Description:Inhibition of [125]I-Bolton Hunter Substance P([125]I-BHSP) binding to standard Tachykinin receptor 1 from rat forebrain membranes.More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetSubstance-P receptor(Rattus norvegicus (rat))
Rochester

Curated by ChEMBL
LigandPNGBDBM50002373(1-(1-ethynyl)-15a,17a-dimethyl-(1R,15aS,17aS)-2,3,...)
Affinity DataIC50:  50nMAssay Description:Inhibition of [125]I-Bolton Hunter Substance P([125]I-BHSP) binding to standard Tachykinin receptor 1 from rat forebrain membranes.More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed