Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2B | P41595 | 3/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.38 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.38 |
| ▸ | FPR2 | P25090 | 1/20 | 0.38 |
| ▸ | CNR1 | P21554 | 1/20 | 0.37 |
| ▸ | USP30 | Q70CQ3 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.36 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.36 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.36 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | RECQL | P46063 | 1/20 | 0.35 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL7316422 | 0.90 | HTR2B (0.40) | HTR2BTP53ALDH1A1FPR2CNR1 | |
| SCHEMBL7311844 | 0.90 | HTR2B (0.44) | HTR2BTP53FPR2CNR1USP30 | |
| SCHEMBL7303264 | 0.87 | HTR2B (0.38) | HTR2BTP53ITGB3ITGA2BUSP30 | |
| SCHEMBL7307896 | 0.84 | HTR2B (0.46) | HTR2BITGB3ITGA2B | |
| SCHEMBL7310427 | 0.84 | HTR2B (0.43) | HTR2BTP53FPR2CNR1USP30 | |
| SCHEMBL7318339 | 0.84 | ITGB3 (0.45) | HTR2BITGB3ITGA2BCHRM1PKM | |
| SCHEMBL7313313 | 0.83 | HTR2B (0.45) | HTR2BITGB3ITGA2B | |
| SCHEMBL7302525 | 0.82 | HTR2B (0.48) | HTR2BITGB3ITGA2B | |
| SCHEMBL7311913 | 0.81 | TP53 (0.47) | TP53FPR2USP30MAPTRECQL | |
| SCHEMBL7314926 | 0.79 | HTR2B (0.40) | HTR2BTP53ITGB3ITGA2BUSP30 |
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 |
|---|---|---|---|---|---|---|---|
| US-5776937-A | Adhesion receptor antagonists | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1998-07-07 | — | — | US | disclosed |
| EP-0711770-A1 | Antagonists of adhesion receptors | MERCK PATENT GmbH (DE) | 1996-05-15 | — | — | EP | disclosed |