Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB1 | P05556 | 2/20 | 0.58 |
| ▸ | ITGAV | P06756 | 1/20 | 0.58 |
| ▸ | CTSS | P25774 | 5/20 | 0.45 |
| ▸ | CTSK | P43235 | 5/20 | 0.45 |
| ▸ | CTSB | P07858 | 3/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | MAPT | P10636 | 3/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | PKM | P14618 | 1/20 | 0.43 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.43 |
| ▸ | CTSL | P07711 | 1/20 | 0.43 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.42 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.39 |
| ▸ | TACR1 | P25103 | 2/20 | 0.38 |
| ▸ | ACE | P12821 | 1/20 | 0.38 |
| ▸ | KLK5 | Q9Y337 | 1/20 | 0.38 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.38 |
| ▸ | ITGA4 | P13612 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL1030225 | 0.93 | ITGB1 (0.59) | ITGB1ITGAVCTSSCTSKCTSB | |
| SCHEMBL3320795 | 0.93 | ITGB1 (0.59) | ITGB1ITGAVCTSSCTSKCTSB | |
| SCHEMBL4627521 | 0.93 | ITGB1 (0.59) | ITGB1ITGAVCTSSCTSKCTSB | |
| SCHEMBL4626858 | 0.90 | ITGB1 (0.71) | ITGB1ITGAVCTSSCTSKCTSB | |
| SCHEMBL3315439 | 0.90 | ITGB1 (0.71) | ITGB1ITGAVCTSSCTSKCTSB | |
| SCHEMBL3318595 | 0.90 | ITGB1 (0.71) | ITGB1ITGAVCTSSCTSKCTSB | |
| SCHEMBL4625521 | 0.85 | ITGB1 (0.49) | ITGB1ITGAVCTSSCTSKCTSB | |
| SCHEMBL3317515 | 0.85 | ITGB1 (0.75) | ITGB1ITGAVMAPTKDM4EITGA4 | |
| SCHEMBL4625325 | 0.84 | CTSS (0.47) | ITGB1ITGAVCTSSCTSKCTSB | |
| SCHEMBL3315305 | 0.82 | ITGB1 (0.52) | ITGB1ITGAVCTSSCTSKCTSB |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008138592-A1 | BICYCLIC AND HETEROBICYCLIC DERIVATIVES, PROCESSES FOR PREPARING THEM AND THEIR USES | UCB PHARMA, S.A. (BE) | 2008-11-20 | — | — | WO | disclosed |
| WO-2008125215-A1 | BICYCLIC AND HETEROBICYCLIC DERIVATIVES, PROCESSES FOR PREPARING THEM AND THEIR USES | UCB PHARMA, S.A. (BE) | 2008-10-23 | — | — | WO | disclosed |