Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 4/20 | 0.62 |
| ▸ | RAB9A | P51151 | 4/20 | 0.62 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.62 |
| ▸ | GAA | P10253 | 1/20 | 0.62 |
| ▸ | MAPT | P10636 | 2/20 | 0.51 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.51 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.51 |
| ▸ | RELA | Q04206 | 1/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.50 |
| ▸ | PKM | P14618 | 1/20 | 0.48 |
| ▸ | GLA | P06280 | 1/20 | 0.48 |
| ▸ | PLAAT3 | P53816 | 2/20 | 0.47 |
| ▸ | PLAAT5 | Q96KN8 | 2/20 | 0.47 |
| ▸ | PLAAT2 | Q9NWW9 | 2/20 | 0.47 |
| ▸ | PLAAT4 | Q9UL19 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.46 |
| ▸ | FPR2 | P25090 | 1/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL2856862 | 0.93 | NPC1 (0.53) | NPC1RAB9ATAAR1GAAMAPT | |
| SCHEMBL2852350 | 0.91 | NPC1 (0.53) | NPC1RAB9ATAAR1GAAMAPT | |
| SCHEMBL2861643 | 0.90 | CNR1 (0.50) | NPC1RAB9ATAAR1GAASMN1; SMN2 | |
| SCHEMBL2860234 | 0.89 | HPGD (0.54) | NPC1RAB9ATAAR1GAAMAPT | |
| SCHEMBL2850323 | 0.88 | MAPT (0.47) | NPC1RAB9ATAAR1GAAMAPT | |
| SCHEMBL2858680 | 0.86 | NPC1 (0.45) | NPC1RAB9ATAAR1GAAMAPT | |
| SCHEMBL2852633 | 0.86 | TAAR1 (0.57) | NPC1RAB9ATAAR1GAAMAPT | |
| SCHEMBL2853261 | 0.84 | SPR (0.48) | NPC1RAB9ATAAR1GAAMAPT | |
| SCHEMBL2859872 | 0.84 | TAAR1 (0.54) | NPC1RAB9ATAAR1GAASMN1; SMN2 | |
| SCHEMBL2854887 | 0.84 | HPGD (0.49) | NPC1RAB9ASMN1; SMN2 |
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-1451160-B1 | PYRAZOLE-AMIDES FOR USE IN THE TREATMENT OF PAIN | ICAGEN INC (US) | 2010-01-13 | — | — | EP | claimed |