Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | TMIGD3 | P0DMS9 | 3/20 | 0.41 |
| ▸ | ADORA1 | P30542 | 3/20 | 0.41 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.41 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.41 |
| ▸ | IMPDH2 | P12268 | 1/20 | 0.40 |
| ▸ | APP | P05067 | 1/20 | 0.40 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.39 |
| ▸ | NAMPT | P43490 | 1/20 | 0.38 |
| ▸ | STAT1 | P42224 | 1/20 | 0.38 |
| ▸ | CASP3 | P42574 | 1/20 | 0.38 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.38 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.38 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.38 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.38 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.38 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.38 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.38 |
| ▸ | CHRNA7 | P36544 | 3/20 | 0.37 |
| ▸ | HTR3A | P46098 | 2/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL6617722 | 0.92 | TMIGD3 (0.43) | RAB9ATMIGD3ADORA1ADORA2AOPRM1 | |
| SCHEMBL6616205 | 0.91 | HTR3A (0.44) | TMIGD3ADORA1ADORA2AOPRM1IMPDH2 | |
| SCHEMBL6617819 | 0.90 | TMIGD3 (0.46) | RAB9ATMIGD3ADORA1ADORA2AOPRM1 | |
| SCHEMBL6619698 | 0.89 | SENP1 (0.46) | TMIGD3ADORA1ADORA2AOPRM1IMPDH2 | |
| SCHEMBL6616786 | 0.88 | TMIGD3 (0.41) | TMIGD3ADORA1ADORA2AOPRM1IMPDH2 | |
| SCHEMBL6617892 | 0.88 | TMIGD3 (0.45) | TMIGD3ADORA1ADORA2AOPRM1IMPDH2 | |
| SCHEMBL6605135 | 0.88 | TMIGD3 (0.42) | TMIGD3ADORA1ADORA2AOPRM1IMPDH2 | |
| SCHEMBL6616434 | 0.86 | TMIGD3 (0.39) | TMIGD3ADORA1ADORA2AOPRM1IMPDH2 | |
| SCHEMBL6621958 | 0.86 | HDAC2 (0.44) | TMIGD3ADORA1ADORA2AOPRM1IMPDH2 | |
| SCHEMBL6618546 | 0.86 | CLK1 (0.42) | TMIGD3ADORA1ADORA2AOPRM1IMPDH2 |
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 | disclosed |
| 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 | disclosed |