Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.54 |
| ▸ | RAB9A | P51151 | 3/20 | 0.54 |
| ▸ | MEN1 | O00255 | 1/20 | 0.54 |
| ▸ | CASP3 | P42574 | 1/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.54 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.54 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.54 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.54 |
| ▸ | PTGS2 | P35354 | 6/20 | 0.46 |
| ▸ | HPGD | P15428 | 2/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.45 |
| ▸ | ACHE | P22303 | 1/20 | 0.43 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.42 |
| ▸ | ABL1 | P00519 | 1/20 | 0.41 |
| ▸ | BCR | P11274 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL4238317 | 0.92 | NPC1 (0.48) | NPC1RAB9AMEN1CASP3KMT2A | |
| SCHEMBL4239559 | 0.79 | PLAU (0.52) | NPC1RAB9AMEN1KMT2APTGS2 | |
| SCHEMBL4243223 | 0.76 | NPC1 (0.42) | NPC1RAB9AMEN1CASP3KMT2A | |
| SCHEMBL4242424 | 0.74 | ALOX5 (0.54) | NPC1RAB9AMEN1KMT2APTGS2 | |
| SCHEMBL4233688 | 0.73 | MEN1 (0.50) | NPC1RAB9AMEN1KMT2APTGS2 | |
| SCHEMBL12298170 | 0.72 | MAPT (0.54) | NPC1RAB9AMEN1KMT2AMAPT | |
| SCHEMBL4067193 | 0.72 | VCP (0.57) | NPC1RAB9AMEN1KMT2AHPGD | |
| SCHEMBL3356660 | 0.71 | RAB9A (0.56) | NPC1RAB9AMEN1CASP3KMT2A | |
| SCHEMBL2210735 | 0.71 | NPC1 (1.00) | NPC1RAB9AMEN1CASP3KMT2A | |
| SCHEMBL4241367 | 0.70 | AMY1A (0.62) | NPC1RAB9AMEN1KMT2APTGS2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009010871-A2 | PYRAZOLE DERIVATIVES AS ANTAGONISTS OF ADENOSINE A3 RECEPTOR | ADDEX PHARMA S.A. (CH) | 2009-01-22 | — | — | WO | disclosed |