Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB3 | P05106 | 5/20 | 0.51 |
| ▸ | ITGAV | P06756 | 5/20 | 0.51 |
| ▸ | RAB9A | P51151 | 4/20 | 0.39 |
| ▸ | PKM | P14618 | 2/20 | 0.39 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 3/20 | 0.34 |
| ▸ | JAK2 | O60674 | 2/20 | 0.34 |
| ▸ | JAK1 | P23458 | 1/20 | 0.34 |
| ▸ | TYK2 | P29597 | 1/20 | 0.34 |
| ▸ | JAK3 | P52333 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | GRM5 | P41594 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | XIAP | P98170 | 1/20 | 0.34 |
| ▸ | BIRC2 | Q13490 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL6941043 | 0.74 | ITGB3 (0.54) | ITGB3ITGAVITGA2B | |
| SCHEMBL6937435 | 0.73 | ITGB3 (0.51) | ITGB3ITGAVRAB9APKMNPC1 | |
| SCHEMBL6934969 | 0.70 | ITGB3 (0.51) | ITGB3ITGAVRAB9AITGA2BNPC1 | |
| SCHEMBL7100373 | 0.68 | ITGB3 (1.00) | ITGB3ITGAVITGA2B | |
| SCHEMBL6935372 | 0.68 | NPC1 (0.38) | ITGB3ITGAVRAB9AITGA2BNPC1 | |
| SCHEMBL6941352 | 0.67 | ITGB3 (0.47) | ITGB3ITGAVITGA2BSMN1; SMN2 | |
| SCHEMBL7879691 | 0.66 | ITGB3 (0.56) | ITGB3ITGAVRAB9AITGA2BNPC1 | |
| SCHEMBL28056305 | 0.66 | MEN1 (0.53) | ITGB3ITGAVRAB9ANPC1JAK2 | |
| SCHEMBL7882801 | 0.62 | ALDH1A1 (0.41) | ITGB3ITGAVKDM4EMAPTNPSR1 | |
| SCHEMBL6941874 | 0.61 | PYGL (0.42) | RAB9ANPC1MEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-1097127-B1 | DIACYLHYDRAZINE DERIVATIVES AS INTEGRIN INHIBITORS | MERCK PATENT GMBH (DE) | 2003-03-12 | — | — | EP | disclosed |
| US-6326403-B1 | CARDIOVASCULAR DISORDERS | MERCK PATENT GESELLSCHAFT MIT (DE) | 2001-12-04 | — | — | US | disclosed |