Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA3 | P0DMS8 | 6/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.55 |
| ▸ | RAB9A | P51151 | 3/20 | 0.53 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.53 |
| ▸ | NFKB2 | Q00653 | 2/20 | 0.53 |
| ▸ | RELA | Q04206 | 2/20 | 0.53 |
| ▸ | POLB | P06746 | 1/20 | 0.51 |
| ▸ | NPC1 | O15118 | 2/20 | 0.50 |
| ▸ | MAPT | P10636 | 2/20 | 0.50 |
| ▸ | PKM | P14618 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
| ▸ | ATR | Q13535 | 2/20 | 0.49 |
| ▸ | HTT | P42858 | 2/20 | 0.48 |
| ▸ | USP2 | O75604 | 1/20 | 0.48 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 2/20 | 0.47 |
| ▸ | TP53 | P04637 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL27828414 | 0.81 | MAPT (0.66) | ADORA3SMN1; SMN2RAB9ANFKB1NFKB2 | |
| SCHEMBL6250524 | 0.80 | SLC7A5 (0.49) | ADORA3MAPTPKMUSP2TP53 | |
| SCHEMBL15958629 | 0.78 | MAPT (0.54) | ADORA3MAPT | |
| SCHEMBL42617 | 0.77 | ALDH1A1 (0.75) | SMN1; SMN2RAB9ANPC1MAPTALDH1A1 | |
| SCHEMBL25868860 | 0.76 | HIF1A (0.54) | ADORA3SMN1; SMN2RAB9APOLBNPC1 | |
| SCHEMBL13595025 | 0.74 | KDM4E (0.53) | SMN1; SMN2ALDH1A1KDM4E | |
| SCHEMBL12669883 | 0.74 | ADORA3 (0.48) | ADORA3SMN1; SMN2L3MBTL1KDM4E | |
| SCHEMBL6990443 | 0.73 | NPC1 (0.51) | SMN1; SMN2RAB9ANPC1ALDH1A1HTT | |
| Bicarbonate SCHEMBL11185192 | 0.72 | ALDH1A1 (0.58) | SMN1; SMN2RAB9AMAPTALDH1A1L3MBTL1 | |
| SCHEMBL13293094 | 0.72 | ADORA3 (0.56) | ADORA3POLBMAPTATRHTT |
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-1458379-A1 | HYDROXYPHENYL-PYRAZOLE DERIVATIVES ACTIVE AS KINASE INHIBITORS, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS COMPRISING THEM | Pharmacia Italia S.p.A. (IT) | 2004-09-22 | — | — | EP | claimed |
| WO-2003051358-A1 | HYDROXYPHENYL-PYRAZOLE DERIVATIVES ACTIVE AS KINASE INHIBITORS, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS COMPRISING THEM | PHARMACIA ITALIA SPA (IT) | 2003-06-26 | — | — | WO | claimed |