Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.42 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.41 |
| ▸ | PTPN1 | P18031 | 3/20 | 0.41 |
| ▸ | PTPN2 | P17706 | 2/20 | 0.41 |
| ▸ | PTPN6 | P29350 | 2/20 | 0.41 |
| ▸ | NPC1 | O15118 | 2/20 | 0.40 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | SMPD1 | P17405 | 1/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.39 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.39 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.39 |
| ▸ | PTPRF | P10586 | 1/20 | 0.39 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.39 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.39 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.39 |
| ▸ | MTNR1A | P48039 | 2/20 | 0.39 |
| ▸ | MTNR1B | P49286 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL23270105 | 0.92 | ALDH1A1 (0.42) | ALDH1A1MAPK1MRGPRX4PTPN1PTPN2 | |
| SCHEMBL31277111 | 0.83 | ALDH1A1 (0.46) | ALDH1A1MAPK1PTPN1PTPN2PTPN6 | |
| SCHEMBL30026693 | 0.83 | ALDH1A1 (0.46) | ALDH1A1MAPK1PTPN1PTPN2PTPN6 | |
| SCHEMBL23540306 | 0.83 | ALDH1A1 (0.46) | ALDH1A1MAPK1PTPN1PTPN2PTPN6 | |
| SCHEMBL30026629 | 0.81 | ALDH1A1 (0.46) | ALDH1A1MAPK1PTPN1PTPN2PTPN6 | |
| SCHEMBL23540790 | 0.81 | ALDH1A1 (0.46) | ALDH1A1MAPK1PTPN1PTPN2PTPN6 | |
| SCHEMBL2892950 | 0.79 | ALDH1A1 (0.48) | ALDH1A1MAPK1PTPN1PTPN2PTPN6 | |
| SCHEMBL28915594 | 0.78 | ALDH1A1 (0.38) | ALDH1A1MAPK1MRGPRX4PTPN1PTPN2 | |
| SCHEMBL2892656 | 0.78 | ALDH1A1 (0.51) | ALDH1A1MAPK1MRGPRX4PTPN1PTPN2 | |
| SCHEMBL22412494 | 0.77 | KEAP1 (0.52) | KEAP1NFE2L2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116348455-A | Protein tyrosine phosphatase inhibitors and methods of use thereof | 卡里科生命科学有限责任公司 | 2023-06-27 | — | — | CN | disclosed |
| CN-112955438-A | Protein tyrosine phosphatase inhibitors and methods of use thereof | 卡里科生命科学有限责任公司 | 2021-06-11 | — | — | CN | disclosed |