Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
| ▸ | GRM4 | Q14833 | 2/20 | 0.40 |
| ▸ | ITGB2 | P05107 | 1/20 | 0.40 |
| ▸ | ICAM1 | P05362 | 1/20 | 0.40 |
| ▸ | ITGAL | P20701 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | CRHBP | P24387 | 1/20 | 0.40 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.38 |
| ▸ | PRKCG | P05129 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL9416349 | 0.81 | CYP3A4 (0.37) | ATMGRM4ITGB2ICAM1ITGAL | |
| SCHEMBL9416351 | 0.77 | AURKA (0.38) | ITGB2ICAM1ITGALMAPTKMT2A | |
| SCHEMBL9416361 | 0.76 | ALDH1A1 (0.38) | ITGB2ICAM1ITGALMAPTKMT2A | |
| SCHEMBL9416345 | 0.75 | PIK3CG (0.36) | ITGB2ICAM1ITGALMAPTKMT2A | |
| SCHEMBL6919650 | 0.73 | KMT2A (0.46) | KMT2APOLBALDH1A1L3MBTL1NPC1 | |
| SCHEMBL9416337 | 0.73 | ITGB2 (0.36) | ITGB2ICAM1ITGALMAPTKMT2A | |
| SCHEMBL9416364 | 0.73 | SMN1; SMN2 (0.48) | ATMITGB2ICAM1ITGALMAPT | |
| SCHEMBL9416332 | 0.72 | ITGB2 (0.46) | ITGB2ICAM1ITGALMAPTKMT2A | |
| SCHEMBL9416360 | 0.71 | ALDH1A1 (0.43) | ITGB2ICAM1ITGALMAPTKMT2A | |
| SCHEMBL9416338 | 0.70 | AURKA (0.36) | TSHRITGB2ICAM1ITGALMAPT |
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-0627423-A1 | SUBSTITUTED PYRAZOLE DERIVATIVE AND AGROHORTICULTURAL BACTERICIDE | NISSAN CHEMICAL INDUSTRIES, LIMITED (JP) | 1994-12-07 | — | — | EP | disclosed |