Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PSEN1 | P49768 | 12/20 | 0.56 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.56 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.56 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.56 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.56 |
| ▸ | TSHR | P16473 | 1/20 | 0.56 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.50 |
| ▸ | GSTO1 | P78417 | 1/20 | 0.50 |
| ▸ | TTPA | P49638 | 2/20 | 0.45 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | PDE4A | P27815 | 1/20 | 0.40 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.40 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL14948984 | 1.00 | PSEN1 (0.56) | PSEN1PTGS1PTGS2CYP1A2CYP3A4 | |
| SCHEMBL16247635 | 0.91 | PTPN1 (0.48) | PSEN1PTGS1PTGS2CYP1A2CYP3A4 | |
| SCHEMBL14948986 | 0.91 | PTPN1 (0.59) | PSEN1PTGS1PTGS2CYP1A2CYP3A4 | |
| SCHEMBL14948991 | 0.91 | PTPN1 (0.59) | PSEN1PTGS1PTGS2CYP1A2CYP3A4 | |
| SCHEMBL8420875 | 0.88 | PSEN1 (0.65) | PSEN1PTGS1PTGS2CYP1A2CYP3A4 | |
| SCHEMBL27553771 | 0.85 | PSEN1 (0.64) | PSEN1PTGS1PTGS2CYP1A2CYP3A4 | |
| SCHEMBL16247634 | 0.82 | PTPN1 (0.58) | PSEN1PTGS1PTGS2CYP1A2CYP3A4 | |
| SCHEMBL16247656 | 0.82 | PSEN1 (0.52) | PSEN1PTPN1GSTO1TTPA | |
| SCHEMBL14950826 | 0.81 | PTPN1 (0.57) | PSEN1PTGS1PTGS2CYP1A2CYP3A4 | |
| SCHEMBL11705224 | 0.81 | PTGS1 (0.66) | PSEN1PTGS1PTGS2CYP1A2CYP3A4 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2013067882-A1 | WATER-SOLUBLE VITAMIN E DERIVATIVE MODIFIED FAT-SOLUBLE ANTI-CANCER DRUG COMPOUND AND FORMULATION, PREPARATION METHOD AND USE THEREOF | 南京美西宁医药科技有限责任公司 (CN) | 2013-05-16 | — | — | WO | disclosed |