Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIRT2 | Q8IXJ6 | 3/20 | 0.59 |
| ▸ | SIRT1 | Q96EB6 | 3/20 | 0.59 |
| ▸ | SIRT3 | Q9NTG7 | 3/20 | 0.59 |
| ▸ | PRSS1 | P07477 | 2/20 | 0.59 |
| ▸ | PRSS2 | P07478 | 2/20 | 0.59 |
| ▸ | PRSS3 | P35030 | 2/20 | 0.59 |
| ▸ | TPSAB1 | Q15661 | 2/20 | 0.59 |
| ▸ | KYNU | Q16719 | 1/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.56 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.56 |
| ▸ | CTSL | P07711 | 2/20 | 0.56 |
| ▸ | CTSS | P25774 | 1/20 | 0.56 |
| ▸ | ITGB3 | P05106 | 4/20 | 0.56 |
| ▸ | ITGA2B | P08514 | 4/20 | 0.56 |
| ▸ | CA1 | P00915 | 1/20 | 0.54 |
| ▸ | CA2 | P00918 | 1/20 | 0.54 |
| ▸ | TLR2 | O60603 | 1/20 | 0.52 |
| ▸ | CTSK | P43235 | 2/20 | 0.52 |
| ▸ | DPP4 | P27487 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL8447232 | 1.00 | SIRT2 (0.59) | SIRT2SIRT1SIRT3PRSS1PRSS2 | |
| Hydrochloric Acid SCHEMBL6236103 | 0.99 | SIRT2 (0.58) | SIRT2SIRT1SIRT3PRSS1PRSS2 | |
| Hydrochloric Acid SCHEMBL6236109 | 0.99 | SIRT2 (0.58) | SIRT2SIRT1SIRT3PRSS1PRSS2 | |
| SCHEMBL6477219 | 0.96 | SIRT2 (0.61) | SIRT2SIRT1SIRT3PRSS1PRSS2 | |
| SCHEMBL1840309 | 0.96 | SIRT2 (0.61) | SIRT2SIRT1SIRT3PRSS1PRSS2 | |
| SCHEMBL1840311 | 0.96 | SIRT2 (0.61) | SIRT2SIRT1SIRT3PRSS1PRSS2 | |
| Hydrochloric Acid SCHEMBL6528872 | 0.95 | SIRT2 (0.60) | SIRT2SIRT1SIRT3PRSS1PRSS2 | |
| Hydrochloric Acid SCHEMBL3952159 | 0.95 | SIRT2 (0.60) | SIRT2SIRT1SIRT3PRSS1PRSS2 | |
| Hydrochloric Acid SCHEMBL3952162 | 0.95 | SIRT2 (0.60) | SIRT2SIRT1SIRT3PRSS1PRSS2 | |
| SCHEMBL22029461 | 0.92 | KYNU (0.60) | SIRT2SIRT1SIRT3KYNUALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0543997-B1 | DERIVATIVES OF METHOTREXATE WITH ANTIRHEUMATIC ACTIVITY | CHUGAI PHARMACEUTICAL CO LTD (JP) | 1999-12-08 | — | — | EP | disclosed |
| EP-0543997-A1 | NOVEL METHOTREXATE DERIVATIVE | Chugai Seiyaku Kabushiki Kaisha (JP) | 1993-06-02 | — | — | EP | disclosed |