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| Reaction Details | |||
|---|---|---|---|
 | Report a problem with these data | ||
| Target | Broad substrate specificity ATP-binding cassette transporter ABCG2 | ||
| Ligand | BDBM50388398 | ||
| Substrate/Competitor | n/a | ||
| Meas. Tech. | ChEMBL_2215560 (CHEMBL5128692) | ||
| IC50 | 5500±n/a nM | ||
| Citation |  Zattoni, IF; Delabio, LC; Dutra, JP; Kita, DH; Scheiffer, G; Hembecker, M; Pereira, GDS; Moure, VR; Valdameri, G Targeting breast cancer resistance protein (BCRP/ABCG2): Functional inhibitors and expression modulators. Eur J Med Chem237:0 (2022) [PubMed] Article | ||
| More Info.: | Get all data from this article, Assay Method | ||
| Broad substrate specificity ATP-binding cassette transporter ABCG2 | |||
| Name: | Broad substrate specificity ATP-binding cassette transporter ABCG2 | ||
| Synonyms: | ABCG2 | ABCG2_HUMAN | ABCP | ATP-Binding Cassette Transporter ABCG2 | ATP-binding cassette sub-family G member 2 | ATP-binding cassette transporter (ABCG2) | ATP-binding cassette, sub-family G, member 2 | BCRP | BCRP1 | Breast cancer resistance protein | CDw338 | MXR | Mitoxantrone resistance-associated protein | Placenta-specific ATP-binding cassette transporter | Urate exporter | ||
| Type: | Multi-pass membrane protein; monomer or homodimer; disulfide-linked | ||
| Mol. Mass.: | 72329.48 | ||
| Organism: | Homo sapiens (Human) | ||
| Description: | Q9UNQ0 | ||
| Residue: | 655 | ||
| Sequence: |
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| BDBM50388398 | |||
| n/a | |||
| Name | BDBM50388398 | ||
| Synonyms: | CHEMBL561057 | SQ-109 | ||
| Type | Small organic molecule | ||
| Emp. Form. | C22H38N2 | ||
| Mol. Mass. | 330.5505 | ||
| SMILES | CC(C)=CCC\C(C)=C\CNCCNC1C2CC3CC(C2)CC1C3 |TLB:18:19:16.17.23:14,23:22:20:16.17.18,13:14:20:16.17.18,13:14:16.17.23:20.19.21,THB:18:17:14:20.19.21,23:17:20:22.14.21,21:19:16:23.22.14,21:22:16:20.18.19,13:14:16:20.18.19,(-5.14,2.27,;-5.13,1.44,;-5.84,1.02,;-4.41,1.04,;-3.7,1.46,;-2.98,1.06,;-2.28,1.48,;-2.29,2.3,;-1.56,1.08,;-.85,1.5,;-.13,1.09,;.58,1.51,;1.3,1.11,;2.04,1.48,;2.72,1.02,;2.74,.22,;2.11,-.47,;2.91,-.24,;3.67,-.52,;4.2,.17,;3.46,-.03,;4.19,.99,;3.44,1.28,;2.89,.61,)| | ||
| Structure | 
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