| Reaction Details |
|---|
 | Report a problem with these data |
| Target | Protein disulfide-isomerase |
|---|
| Ligand | BDBM41972 |
|---|
| Substrate/Competitor | n/a |
|---|
| Meas. Tech. | ChEMBL_2074276 (CHEMBL4729810) |
|---|
| IC50 | <200±n/a nM |
|---|
| Citation |  Shergalis, A; Xue, D; Gharbia, FZ; Driks, H; Shrestha, B; Tanweer, A; Cromer, K; Ljungman, M; Neamati, N Characterization of Aminobenzylphenols as Protein Disulfide Isomerase Inhibitors in Glioblastoma Cell Lines. J Med Chem63:10263-10286 (2020) [PubMed] Article |
|---|
| More Info.: | Get all data from this article, Assay Method |
|---|
| |
| Protein disulfide-isomerase |
|---|
| Name: | Protein disulfide-isomerase |
|---|
| Synonyms: | Cellular thyroid hormone-binding protein | ERBA2L | P4HB | PDI | PDIA1 | PDIA1_HUMAN | PO4DB | Protein Disulfide-Isomerase (PDI) |
|---|
| Type: | Protein |
|---|
| Mol. Mass.: | 57084.91 |
|---|
| Organism: | Homo sapiens (Human) |
|---|
| Description: | P07237 |
|---|
| Residue: | 508 |
|---|
| Sequence: | MLRRALLCLAVAALVRADAPEEEDHVLVLRKSNFAEALAAHKYLLVEFYAPWCGHCKALA
PEYAKAAGKLKAEGSEIRLAKVDATEESDLAQQYGVRGYPTIKFFRNGDTASPKEYTAGR
EADDIVNWLKKRTGPAATTLPDGAAAESLVESSEVAVIGFFKDVESDSAKQFLQAAEAID
DIPFGITSNSDVFSKYQLDKDGVVLFKKFDEGRNNFEGEVTKENLLDFIKHNQLPLVIEF
TEQTAPKIFGGEIKTHILLFLPKSVSDYDGKLSNFKTAAESFKGKILFIFIDSDHTDNQR
ILEFFGLKKEECPAVRLITLEEEMTKYKPESEELTAERITEFCHRFLEGKIKPHLMSQEL
PEDWDKQPVKVLVGKNFEDVAFDEKKNVFVEFYAPWCGHCKQLAPIWDKLGETYKDHENI
VIAKMDSTANEVEAVKVHSFPTLKFFPASADRTVIDYNGERTLDGFKKFLESGGQDGAGD
DDDLEDLEEAEEPDMEEDDDQKAVKDEL
|
|
|
|---|
| BDBM41972 |
|---|
| n/a |
|---|
| Name | BDBM41972 |
|---|
| Synonyms: | 6-[(4-fluorophenyl)-(1-pyrrolidinyl)methyl]-1,3-benzodioxol-5-ol | 6-[(4-fluorophenyl)-pyrrolidin-1-yl-methyl]-1,3-benzodioxol-5-ol | 6-[(4-fluorophenyl)-pyrrolidin-1-ylmethyl]-1,3-benzodioxol-5-ol | 6-[(4-fluorophenyl)-pyrrolidino-methyl]sesamol | cid_340204 |
|---|
| Type | Small organic molecule |
|---|
| Emp. Form. | C18H18FNO3 |
|---|
| Mol. Mass. | 315.3388 |
|---|
| SMILES | Oc1cc2OCOc2cc1C(N1CCCC1)c1ccc(F)cc1 |
|---|
| Structure | 
|
|---|
Search and Browse
