| Reaction Details |
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 | Report a problem with these data |
| Target | C-X-C chemokine receptor type 4 |
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| Ligand | BDBM50270016 |
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| Substrate/Competitor | n/a |
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| Meas. Tech. | ChEBML_1707951 |
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| IC50 | 5.5±n/a nM |
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| Citation |  Miller, EJ; Jecs, E; Truax, VM; Katzman, BM; Tahirovic, YA; Wilson, RJ; Kuo, KM; Kim, MB; Nguyen, HH; Saindane, MT; Zhao, H; Wang, T; Sum, CS; Cvijic, ME; Schroeder, GM; Wilson, LJ; Liotta, DC Discovery of Tetrahydroisoquinoline-Containing CXCR4 Antagonists with Improved in Vitro ADMET Properties. J Med Chem61:946-979 (2018) [PubMed] Article |
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| More Info.: | Get all data from this article, Assay Method |
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| C-X-C chemokine receptor type 4 |
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| Name: | C-X-C chemokine receptor type 4 |
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| Synonyms: | CD_antigen=CD184 | CXC-R4 | CXCR-4 | CXCR4_MOUSE | Cmkar4 | Cxcr4 | Fusin | Lestr | Leukocyte-derived seven transmembrane domain receptor | PB-CKR | Pre-B-cell-derived chemokine receptor | SDF-1 receptor | Sdf1r | Stromal cell-derived factor 1 receptor |
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| Type: | PROTEIN |
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| Mol. Mass.: | 40435.89 |
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| Organism: | Mus musculus |
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| Description: | ChEMBL_656729 |
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| Residue: | 359 |
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| Sequence: | MEPISVSIYTSDNYSEEVGSGDYDSNKEPCFRDENVHFNRIFLPTIYFIIFLTGIVGNGL
VILVMGYQKKLRSMTDKYRLHLSVADLLFVITLPFWAVDAMADWYFGKFLCKAVHIIYTV
NLYSSVLILAFISLDRYLAIVHATNSQRPRKLLAEKAVYVGVWIPALLLTIPDFIFADVS
QGDISQGDDRYICDRLYPDSLWMVVFQFQHIMVGLILPGIVILSCYCIIISKLSHSKGHQ
KRKALKTTVILILAFFACWLPYYVGISIDSFILLGVIKQGCDFESIVHKWISITEALAFF
HCCLNPILYAFLGAKFKSSAQHALNSMSRGSSLKILSKGKRGGHSSVSTESESSSFHSS
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| BDBM50270016 |
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| n/a |
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| Name | BDBM50270016 |
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| Synonyms: | CHEMBL4070320 |
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| Type | Small organic molecule |
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| Emp. Form. | C29H40N4O |
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| Mol. Mass. | 460.6541 |
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| SMILES | C(NCC1CCOCC1)\C=C\CN(C[C@H]1Cc2ccccc2CN1)[C@H]1CCCc2cccnc12 |r| |
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| Structure | 
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