Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB3 | P05106 | 7/20 | 0.46 |
| ▸ | ITGAV | P06756 | 7/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | F10 | P00742 | 2/20 | 0.38 |
| ▸ | ALPL | P05186 | 1/20 | 0.37 |
| ▸ | ALPI | P09923 | 1/20 | 0.37 |
| ▸ | ALPG | P10696 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | BDKRB2 | P30411 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 2/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | THRB | P10828 | 1/20 | 0.36 |
| ▸ | HPN | P05981 | 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 | |
|---|---|---|---|---|
| SCHEMBL7474158 | 0.94 | ITGB3 (0.48) | ITGB3ITGAVALPLALPIALPG | |
| SCHEMBL7161061 | 0.93 | ITGB3 (0.51) | ITGB3ITGAVMAPTALPLALPI | |
| SCHEMBL7364374 | 0.92 | ITGB3 (0.44) | ITGB3ITGAVMAPTALPLALPI | |
| SCHEMBL7472561 | 0.90 | ITGB3 (0.41) | ITGB3ITGAVMAPTF10ALDH1A1 | |
| SCHEMBL7468966 | 0.89 | BDKRB1 (0.39) | ITGB3ITGAVMAPTF10TP53 | |
| SCHEMBL7371688 | 0.89 | ITGB3 (0.40) | ITGB3ITGAVALDH1A1NPC1TP53 | |
| SCHEMBL7161068 | 0.87 | ITGB3 (0.54) | ITGB3ITGAVALPLALPIALPG | |
| SCHEMBL7364536 | 0.86 | F10 (0.44) | ITGB3F10HSD17B10HPNST14 | |
| SCHEMBL7468102 | 0.86 | NPC1 (0.41) | ITGB3ITGAVALDH1A1BDKRB2NPC1 | |
| SCHEMBL7371562 | 0.86 | THRB (0.39) | ITGB3ITGAVALDH1A1NPC1TP53 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0964856-B1 | BICYCLIC AMINO ACIDS | MERCK PATENT GMBH (DE) | 2002-10-09 | — | — | EP | disclosed |
| EP-0964856-A1 | BICYCLIC AMINO ACIDS | MERCK PATENT GmbH (DE) | 1999-12-22 | — | — | EP | disclosed |
| WO-1998035949-A1 | BICYCLIC AMINO ACIDS | MERCK PATENT GMBH (DE) | 1998-08-20 | — | — | WO | disclosed |