Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTPN1 | P18031 | 1/20 | 0.43 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.42 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.39 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.39 |
| ▸ | SELP | P16109 | 4/20 | 0.35 |
| ▸ | SELE | P16581 | 2/20 | 0.35 |
| ▸ | RAF1 | P04049 | 1/20 | 0.35 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.35 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.35 |
| ▸ | GCGR | P47871 | 1/20 | 0.35 |
| ▸ | MAPK12 | P53778 | 1/20 | 0.35 |
| ▸ | MAPK11 | Q15759 | 1/20 | 0.35 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.35 |
| ▸ | NOX1 | Q9Y5S8 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL3826599 | 0.84 | MEN1 (0.37) | RAF1NOX1MAPTMEN1KMT2A | |
| SCHEMBL32673048 | 0.77 | PTPN1 (0.52) | PTPN1ABCB1ADORA3ADORA2BSELP | |
| SCHEMBL13780575 | 0.75 | MAPT (0.47) | PTPN1ABCB1ADORA3ADORA2BSELP | |
| SCHEMBL13679655 | 0.75 | PTPN1 (0.46) | PTPN1ABCB1ADORA3ADORA2BRAF1 | |
| SCHEMBL27499157 | 0.74 | CA12 (0.57) | PTPN1MAPTMEN1KMT2AKDM4E | |
| SCHEMBL6611775 | 0.72 | PTPN1 (0.51) | PTPN1ABCB1ADORA3ADORA2BSELP | |
| SCHEMBL717762 | 0.70 | ABCB1 (0.68) | PTPN1ABCB1SELPSELERAF1 | |
| SCHEMBL3831111 | 0.70 | PTPN1 (0.48) | PTPN1ABCB1ADORA3ADORA2BSELP | |
| SCHEMBL13679695 | 0.69 | NOX1 (0.45) | PTPN1ADORA3ADORA2BSELPALOX5 | |
| SCHEMBL13679693 | 0.68 | PTPN1 (0.50) | PTPN1ABCB1ADORA3ADORA2BSELP |
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 |
|---|---|---|---|---|---|---|---|
| EP-0999835-B1 | IMIDAZOLE DERIVATIVES AS MDR MODULATORS | TAIJI BIOMEDICAL INC (US) | 2009-09-09 | — | — | EP | disclosed |