| Reaction Details |
|---|
 | Report a problem with these data |
| Target | Exportin-1 |
|---|
| Ligand | BDBM50527779 |
|---|
| Substrate/Competitor | n/a |
|---|
| Meas. Tech. | ChEMBL_1903487 (CHEMBL4405709) |
|---|
| IC50 | 151±n/a nM |
|---|
| Citation |  Tian, X; Gao, J; Liu, M; Lei, Y; Wang, F; Chen, J; Chu, P; Gao, J; Long, F; Liang, M; Long, X; Chu, H; Liu, C; Li, X; Sun, Q; Li, G; Yang, Y Small-Molecule Antagonist Targeting Exportin-1 via Rational Structure-Based Discovery. J Med Chem63:3881-3895 (2020) [PubMed] Article |
|---|
| More Info.: | Get all data from this article, Assay Method |
|---|
| |
| Exportin-1 |
|---|
| Name: | Exportin-1 |
|---|
| Synonyms: | CRM1 | XPO1 | XPO1_HUMAN |
|---|
| Type: | PROTEIN |
|---|
| Mol. Mass.: | 123374.43 |
|---|
| Organism: | Homo sapiens (Human) |
|---|
| Description: | ChEMBL_635789 |
|---|
| Residue: | 1071 |
|---|
| Sequence: | MPAIMTMLADHAARQLLDFSQKLDINLLDNVVNCLYHGEGAQQRMAQEVLTHLKEHPDAW
TRVDTILEFSQNMNTKYYGLQILENVIKTRWKILPRNQCEGIKKYVVGLIIKTSSDPTCV
EKEKVYIGKLNMILVQILKQEWPKHWPTFISDIVGASRTSESLCQNNMVILKLLSEEVFD
FSSGQITQVKSKHLKDSMCNEFSQIFQLCQFVMENSQNAPLVHATLETLLRFLNWIPLGY
IFETKLISTLIYKFLNVPMFRNVSLKCLTEIAGVSVSQYEEQFVTLFTLTMMQLKQMLPL
NTNIRLAYSNGKDDEQNFIQNLSLFLCTFLKEHDQLIEKRLNLRETLMEALHYMLLVSEV
EETEIFKICLEYWNHLAAELYRESPFSTSASPLLSGSQHFDVPPRRQLYLPMLFKVRLLM
VSRMAKPEEVLVVENDQGEVVREFMKDTDSINLYKNMRETLVYLTHLDYVDTERIMTEKL
HNQVNGTEWSWKNLNTLCWAIGSISGAMHEEDEKRFLVTVIKDLLGLCEQKRGKDNKAII
ASNIMYIVGQYPRFLRAHWKFLKTVVNKLFEFMHETHDGVQDMACDTFIKIAQKCRRHFV
QVQVGEVMPFIDEILNNINTIICDLQPQQVHTFYEAVGYMIGAQTDQTVQEHLIEKYMLL
PNQVWDSIIQQATKNVDILKDPETVKQLGSILKTNVRACKAVGHPFVIQLGRIYLDMLNV
YKCLSENISAAIQANGEMVTKQPLIRSMRTVKRETLKLISGWVSRSNDPQMVAENFVPPL
LDAVLIDYQRNVPAAREPEVLSTMAIIVNKLGGHITAEIPQIFDAVFECTLNMINKDFEE
YPEHRTNFFLLLQAVNSHCFPAFLAIPPTQFKLVLDSIIWAFKHTMRNVADTGLQILFTL
LQNVAQEEAAAQSFYQTYFCDILQHIFSVVTDTSHTAGLTMHASILAYMFNLVEEGKIST
SLNPGNPVNNQIFLQEYVANLLKSAFPHLQDAQVKLFVTGLFSLNQDIPAFKEHLRDFLV
QIKEFAGEDTSDLFLEEREIALRQADEEKHKRQMSVPGIFNPHEIPEEMCD
|
|
|
|---|
| BDBM50527779 |
|---|
| n/a |
|---|
| Name | BDBM50527779 |
|---|
| Synonyms: | CHEMBL4440028 |
|---|
| Type | Small organic molecule |
|---|
| Emp. Form. | C13H9F6NOS2 |
|---|
| Mol. Mass. | 373.337 |
|---|
| SMILES | [O-][S@@+](\C=C\CCN=C=S)c1cc(cc(c1)C(F)(F)F)C(F)(F)F |r| |
|---|
| Structure | 
|
|---|
Search and Browse
