Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEP1B | Q16820 | 2/20 | 0.40 |
| ▸ | PPARG | P37231 | 2/20 | 0.38 |
| ▸ | ITGB3 | P05106 | 5/20 | 0.36 |
| ▸ | ITGAV | P06756 | 4/20 | 0.36 |
| ▸ | ITGB1 | P05556 | 1/20 | 0.36 |
| ▸ | ITGA5 | P08648 | 1/20 | 0.36 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.36 |
| ▸ | LIPG | Q9Y5X9 | 1/20 | 0.35 |
| ▸ | F10 | P00742 | 1/20 | 0.34 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.34 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.34 |
| ▸ | TMPRSS15 | P98073 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | FNTA | P49354 | 2/20 | 0.34 |
| ▸ | FNTB | P49356 | 2/20 | 0.34 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.34 |
| ▸ | HPGDS | O60760 | 1/20 | 0.34 |
| ▸ | ITGA2B | P08514 | 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 | |
|---|---|---|---|---|
| SCHEMBL6938684 | 0.84 | ITGB3 (0.43) | ITGB3ITGAVMEN1KMT2AITGA2B | |
| SCHEMBL7878241 | 0.81 | KCNA5 (0.37) | ITGB3PRSS1TMPRSS15ITGA2B | |
| SCHEMBL6937428 | 0.77 | ITGB3 (0.40) | ITGB3PRSS1TMPRSS15ITGA2B | |
| SCHEMBL6939377 | 0.74 | SELP (0.36) | PPARGITGB3FNTAFNTBNR1H4 | |
| SCHEMBL7879657 | 0.74 | ABCC1 (0.39) | ITGB3PRSS1TMPRSS15KMT2AITGA2B | |
| SCHEMBL6938012 | 0.70 | NPY4R (0.32) | — | |
| SCHEMBL20487535 | 0.70 | NR1H4 (0.56) | MEP1BF10KMT2AFNTAFNTB | |
| SCHEMBL7878251 | 0.70 | PRSS1 (0.35) | ITGB3ITGAVPRSS1TMPRSS15ITGA2B | |
| Hydrochloric Acid SCHEMBL7327435 | 0.69 | NR1H4 (0.55) | MEP1BF10KMT2AFNTAFNTB | |
| SCHEMBL30940553 | 0.69 | F10 (0.60) | MEP1BF10ROCK2PRSS1 |
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 |
|---|---|---|---|---|---|---|---|
| US-6326403-B1 | CARDIOVASCULAR DISORDERS | MERCK PATENT GESELLSCHAFT MIT (DE) | 2001-12-04 | — | — | US | claimed |
| 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 |