Reaction Details | |||
---|---|---|---|
Report a problem with these data | |||
Target | Solute carrier organic anion transporter family member 1B1 | ||
Ligand | BDBM23223 | ||
Substrate/Competitor | n/a | ||
Meas. Tech. | ChEMBL_1265864 (CHEMBL3039490) | ||
Ki | 1780±n/a nM | ||
Citation | De Bruyn, T; van Westen, GJ; Ijzerman, AP; Stieger, B; de Witte, P; Augustijns, PF; Annaert, PP Structure-based identification of OATP1B1/3 inhibitors. Mol Pharmacol83:1257-67 (2013) [PubMed] Article | ||
More Info.: | Get all data from this article, Assay Method | ||
Solute carrier organic anion transporter family member 1B1 | |||
Name: | Solute carrier organic anion transporter family member 1B1 | ||
Synonyms: | LST1 | OATP1B1 | OATP2 | OATPC | SLC21A6 | SLCO1B1 | SO1B1_HUMAN | Solute carrier organic anion transporter family member 1B1 | Solute carrier organic anion transporter family member 1B1 (OATP1B1) | Thromboxane B2 | ||
Type: | Protein | ||
Mol. Mass.: | 76468.06 | ||
Organism: | Homo sapiens (Human) | ||
Description: | Q9Y6L6 | ||
Residue: | 691 | ||
Sequence: |
| ||
BDBM23223 | |||
n/a | |||
Name | BDBM23223 | ||
Synonyms: | 7-[8-formyl-1,6,7-trihydroxy-3-methyl-5-(propan-2-yl)naphthalen-2-yl]-2,3,8-trihydroxy-6-methyl-4-(propan-2-yl)naphthalene-1-carbaldehyde | CHEMBL51483 | Gossypol | Gossypol (C9) | Gossypol, 4 | Pogosin | Tash 1 | US9115061, Gossypol | cid_3503 | ||
Type | Small organic molecule | ||
Emp. Form. | C30H30O8 | ||
Mol. Mass. | 518.5544 | ||
SMILES | CC(C)c1c(O)c(O)c(C=O)c2c(O)c(c(C)cc12)-c1c(C)cc2c(C(C)C)c(O)c(O)c(C=O)c2c1O |(-4.44,-1.63,;-5.78,-.86,;-7.11,-1.63,;-5.78,.68,;-7.11,1.45,;-8.44,.68,;-7.11,2.99,;-8.44,3.76,;-5.78,3.76,;-5.78,5.3,;-4.44,6.07,;-4.44,2.99,;-3.11,3.76,;-3.11,5.3,;-1.77,2.99,;-1.77,1.45,;-.44,.68,;-3.11,.68,;-4.44,1.45,;-.44,3.76,;-.44,5.3,;-1.77,6.07,;.89,6.07,;2.23,5.3,;3.56,6.07,;3.56,7.61,;4.89,8.38,;2.23,8.38,;4.89,5.3,;6.23,6.07,;4.89,3.76,;6.23,2.99,;3.56,2.99,;3.56,1.45,;4.89,.68,;2.23,3.76,;.89,2.99,;.89,1.45,)| | ||
Structure |