BDBM36822 1-(10,11-Dihydro-dibenzo[b,f]azepin-5-yl)-2-[5-(1H-indol-3-yl)-[1,3,4]oxadiazol-2-ylsulfanyl]-ethanone::1-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)-2-[[(2Z)-2-(3-indolylidene)-3H-1,3,4-oxadiazol-5-yl]thio]ethanone::1-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)-2-[[(2Z)-2-indol-3-ylidene-3H-1,3,4-oxadiazol-5-yl]sulfanyl]ethanone::1-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)-2-[[(2Z)-2-indol-3-ylidene-3H-1,3,4-oxadiazol-5-yl]thio]ethanone::MLS000031731::SMR000003754::cid_5770832
SMILES: O=C(CSc1nnc(o1)-c1c[nH]c2ccccc12)N1c2ccccc2CCc2ccccc12
InChI Key: InChIKey=DIPLADCLJYNRDD-UHFFFAOYSA-N
Data: 3 EC50
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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Sphingosine 1-phosphate receptor 1 (Homo sapiens (Human)) | BDBM36822 (1-(10,11-Dihydro-dibenzo[b,f]azepin-5-yl)-2-[5-(1H...) | PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet | Purchase PC cid PC sid UniChem Similars | PCBioAssay | n/a | n/a | n/a | n/a | >9.51E+4 | n/a | n/a | n/a | n/a |
The Scripps Research Institute Molecular Screening Center Curated by PubChem BioAssay | Assay Description Source (MLSCN Center Name): The Scripps Research Institute Molecular Screening Center Center Affiliation: The Scripps Research Institute, TSRI Assay ... | PubChem Bioassay (2007) BindingDB Entry DOI: 10.7270/Q25X2795 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Sphingosine 1-phosphate receptor 1 (Homo sapiens (Human)) | BDBM36822 (1-(10,11-Dihydro-dibenzo[b,f]azepin-5-yl)-2-[5-(1H...) | PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet | Purchase PC cid PC sid UniChem Similars | PCBioAssay | n/a | n/a | n/a | n/a | 7.48E+3 | n/a | n/a | n/a | n/a |
The Scripps Research Institute Molecular Screening Center Curated by PubChem BioAssay | Assay Description Source (MLSCN Center Name): The Scripps Research Institute Molecular Screening Center Center Affiliation: The Scripps Research Institute, TSRI Assay ... | PubChem Bioassay (2007) BindingDB Entry DOI: 10.7270/Q2ZC817P | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Sphingosine 1-phosphate receptor 1 (Homo sapiens (Human)) | BDBM36822 (1-(10,11-Dihydro-dibenzo[b,f]azepin-5-yl)-2-[5-(1H...) | PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet | Purchase PC cid PC sid UniChem Similars | PCBioAssay | n/a | n/a | n/a | n/a | 7.08E+3 | n/a | n/a | n/a | n/a |
The Scripps Research Institute Molecular Screening Center Curated by PubChem BioAssay | Assay Description Source (MLSCN Center Name): The Scripps Research Institute Molecular Screening Center Center Affiliation: The Scripps Research Institute, TSRI Assay ... | PubChem Bioassay (2007) BindingDB Entry DOI: 10.7270/Q2251GJ9 | |||||||||||
More data for this Ligand-Target Pair |