Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.39 |
| ▸ | MAPT | P10636 | 4/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | CTSS | P25774 | 2/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | PSMB8 | P28062 | 1/20 | 0.37 |
| ▸ | PSMB5 | P28074 | 1/20 | 0.37 |
| ▸ | PSMB10 | P40306 | 1/20 | 0.37 |
| ▸ | PSMB2 | P49721 | 1/20 | 0.37 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.37 |
| ▸ | AVPR2 | P30518 | 1/20 | 0.37 |
| ▸ | OXTR | P30559 | 1/20 | 0.37 |
| ▸ | AVPR1A | P37288 | 1/20 | 0.37 |
| ▸ | REN | P00797 | 1/20 | 0.36 |
| ▸ | USP2 | O75604 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL7042159 | 0.92 | CTSK (0.45) | CTSS | |
| SCHEMBL6462350 | 0.87 | CTSL (0.45) | CTSS | |
| SCHEMBL6466880 | 0.85 | PSMB2 (0.45) | MAPTCTSSPSMB8PSMB5PSMB10 | |
| SCHEMBL6465946 | 0.85 | ALDH1A1 (0.41) | ALDH1A1MAPTRAB9ACTSSNPSR1 | |
| SCHEMBL6466258 | 0.79 | ANPEP (0.46) | RAB9ANPC1SMN1; SMN2PSMB5PSMB2 | |
| SCHEMBL6467305 | 0.78 | MMP9 (0.44) | LMNAPSMB5PSMB2REN | |
| SCHEMBL6467310 | 0.78 | MMP9 (0.44) | LMNAPSMB5PSMB2REN | |
| SCHEMBL6466256 | 0.78 | MMP9 (0.44) | LMNAPSMB5PSMB2REN | |
| SCHEMBL6061535 | 0.78 | CTSK (0.51) | CTSS | |
| SCHEMBL6063162 | 0.78 | CTSL (0.45) | CTSS |
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-1516877-A1 | Amine derivatives as protease inhibitors | AXYS PHARMACEUTICALS, INC. (US) | 2005-03-23 | — | — | EP | disclosed |