Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB1 | P05556 | 5/20 | 0.51 |
| ▸ | ITGA4 | P13612 | 5/20 | 0.51 |
| ▸ | FPR2 | P25090 | 2/20 | 0.49 |
| ▸ | MMP3 | P08254 | 6/20 | 0.48 |
| ▸ | MMP2 | P08253 | 3/20 | 0.48 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | REN | P00797 | 1/20 | 0.46 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.45 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.45 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.45 |
| ▸ | HDAC7 | Q8WUI4 | 2/20 | 0.45 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.45 |
| ▸ | HDAC10 | Q969S8 | 2/20 | 0.45 |
| ▸ | HDAC11 | Q96DB2 | 2/20 | 0.45 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.45 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.45 |
| ▸ | HDAC9 | Q9UKV0 | 2/20 | 0.45 |
| ▸ | HDAC5 | Q9UQL6 | 2/20 | 0.45 |
| ▸ | MME | P08473 | 1/20 | 0.45 |
| ▸ | ACE | P12821 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL7546168 | 0.93 | ITGB1 (0.54) | ITGB1ITGA4FPR2MMP3MMP2 | |
| SCHEMBL7540570 | 0.93 | ITGB1 (0.54) | ITGB1ITGA4FPR2MMP3MMP2 | |
| SCHEMBL7545880 | 0.88 | FPR2 (0.55) | ITGB1ITGA4FPR2MMP3MMP2 | |
| SCHEMBL7548271 | 0.86 | FOLH1 (0.51) | ITGB1ITGA4MMP3MMP2MAPT | |
| SCHEMBL7538645 | 0.85 | ITGB1 (0.52) | ITGB1ITGA4FPR2MMP3MMP2 | |
| SCHEMBL7538353 | 0.85 | MMP3 (0.51) | ITGB1ITGA4MMP3MMP2MAPT | |
| SCHEMBL7546261 | 0.82 | MEN1 (0.48) | ITGB1ITGA4MMP3MMP2MAPT | |
| SCHEMBL7539261 | 0.81 | MMP3 (0.47) | ITGB1ITGA4MMP3MMP2MME | |
| SCHEMBL7543834 | 0.80 | MMP3 (0.46) | ITGB1ITGA4MMP3MMP2MME | |
| SCHEMBL7543837 | 0.80 | MMP3 (0.46) | ITGB1ITGA4MMP3MMP2MME |
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-1209147-A1 | CARBOXYLIC ACID DERIVATIVES AND ADHESION MOLECULE INHIBITORS CONTAINING THE SAME AS THE ACTIVE INGREDIENT | TORAY INDUSTRIES, INC. (JP) | 2002-05-29 | — | — | EP | disclosed |