Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB1 | P05556 | 8/20 | 0.42 |
| ▸ | ITGA4 | P13612 | 8/20 | 0.42 |
| ▸ | ANPEP | P15144 | 1/20 | 0.41 |
| ▸ | REN | P00797 | 1/20 | 0.40 |
| ▸ | CTSL | P07711 | 1/20 | 0.40 |
| ▸ | BIRC2 | Q13490 | 1/20 | 0.40 |
| ▸ | MMP3 | P08254 | 3/20 | 0.39 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.39 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.39 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.39 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.39 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.39 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.39 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.39 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.39 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.39 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.39 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.39 |
| ▸ | MMP2 | P08253 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL7538506 | 1.00 | ITGB1 (0.42) | ITGB1ITGA4ANPEPRENCTSL | |
| SCHEMBL7541642 | 0.93 | ITGB1 (0.47) | ITGB1ITGA4ANPEPRENCTSL | |
| SCHEMBL7538982 | 0.91 | ITGB1 (0.44) | ITGB1ITGA4MMP3MMP2MMP1 | |
| SCHEMBL7541939 | 0.91 | ITGB1 (0.44) | ITGB1ITGA4MMP3MMP2MMP1 | |
| SCHEMBL7546281 | 0.91 | ITGB1 (0.44) | ITGB1ITGA4MMP3MMP2MMP1 | |
| SCHEMBL7541947 | 0.91 | ITGB1 (0.44) | ITGB1ITGA4MMP3MMP2MMP1 | |
| SCHEMBL7538562 | 0.87 | ANPEP (0.49) | ITGB1ITGA4ANPEPMMP3HDAC3 | |
| SCHEMBL7545838 | 0.87 | ANPEP (0.49) | ITGB1ITGA4ANPEPMMP3HDAC3 | |
| SCHEMBL7539011 | 0.87 | HDAC3 (0.39) | ANPEPRENBIRC2HDAC3HDAC4 | |
| SCHEMBL7539014 | 0.87 | HDAC3 (0.39) | ANPEPRENBIRC2HDAC3HDAC4 |
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 |