Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ENPEP | Q07075 | 2/20 | 0.53 |
| ▸ | TACR3 | P29371 | 4/20 | 0.48 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.47 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.47 |
| ▸ | MMP8 | P22894 | 4/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.44 |
| ▸ | RECQL | P46063 | 2/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | PPARG | P37231 | 1/20 | 0.43 |
| ▸ | PPARA | Q07869 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL22033112 | 0.87 | BLM (0.53) | ENPEPTACR3ITGB3ITGA2BALDH1A1 | |
| SCHEMBL1552723 | 0.87 | CA12 (0.50) | ENPEPTACR3ITGB3ITGA2BMMP8 | |
| SCHEMBL1350805 | 0.87 | CA12 (0.50) | ENPEPTACR3ITGB3ITGA2BMMP8 | |
| SCHEMBL1350802 | 0.87 | CA12 (0.50) | ENPEPTACR3ITGB3ITGA2BMMP8 | |
| SCHEMBL28199355 | 0.86 | ITGB3 (0.60) | ENPEPTACR3ITGB3ITGA2BMMP8 | |
| SCHEMBL7271610 | 0.86 | MMP8 (0.57) | ENPEPTACR3ITGB3ITGA2BMMP8 | |
| SCHEMBL10654800 | 0.86 | ITGB3 (0.60) | ENPEPTACR3ITGB3ITGA2BMMP8 | |
| SCHEMBL10655573 | 0.86 | ITGB3 (0.60) | ENPEPTACR3ITGB3ITGA2BMMP8 | |
| SCHEMBL27512959 | 0.86 | ENPEP (0.47) | ENPEPTACR3ITGB3ITGA2BMMP8 | |
| SCHEMBL7271605 | 0.86 | MMP8 (0.57) | ENPEPTACR3ITGB3ITGA2BMMP8 |
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 |
|---|---|---|---|---|---|---|---|
| US-5847144-A | Process for manufacturing α,α'-diaminoalcohol | HOFFMANN-LA ROCHE INC. (US) | 1998-12-08 | — | — | US | disclosed |