Brief Information of the Compound and Protein
Compound Name
(2S,5S,8S,14S,32S,35R,38S,46E,50S,54S)-54-[(5-fluoro-1H-indol-3-yl)methyl]-5-[(1R)-1-methoxyethyl]-8-[(4-methoxyphenyl)methyl]-14,32,35-trimethyl-49-oxa-19,27-dithia-1,4,7,10,16,31,34,37,55-nonazahexacyclo[36.14.4.121,25.140,44.02,50.010,14]octapentaconta-21,23,25(58),40,42,44(57),46-heptaene-3,6,9,15,30,33,36,53,56-nonone
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PubChem ID
CID: 166635746
Canonical SMILES
COc1ccc(C[C@@H]2NC(=O)[C@H]([C@@H](C)OC)NC(=O)[C@@H]3[C@@H]4CCN3C(=O)[C@H](Cc3c[nH]c5ccc(F)cc35)NC(=O)[C@H](Cc3cccc(c3)C/C=C/CO4)NC(=O)[C@@H](C)NC(=O)[C@H](C)NC(=O)CCSCc3cccc(c3)CSCCNC(=O)[C@]3(C)CCCN3C2=O)cc1
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Compound Formula C69H85FN10O12S2
Compound Structure
Protein Name
Solute carrier organic anion transporter family member 1B1
Protein Classification
Transporter
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Electrochemical transporter
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SLC superfamily of solute carriers
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SLC21/SLCO family of organic anion transporting polypeptides
Uniprot ID
Q9Y6L6
Gene Name
SLCO1B1
Table of Molecular Bioactivities Related to the Compound and Protein
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000006 HEK293 Homo sapiens (Human)  1
1
EC50 = 130 nM
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