Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 2/20 | 0.93 |
| ▸ | HTT | P42858 | 1/20 | 0.93 |
| ▸ | RECQL | P46063 | 1/20 | 0.93 |
| ▸ | BCHE | P06276 | 1/20 | 0.69 |
| ▸ | ACHE | P22303 | 1/20 | 0.69 |
| ▸ | NPC1 | O15118 | 1/20 | 0.65 |
| ▸ | RAB9A | P51151 | 1/20 | 0.65 |
| ▸ | MAPT | P10636 | 3/20 | 0.62 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.62 |
| ▸ | GAA | P10253 | 1/20 | 0.62 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.58 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.56 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.55 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.54 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.54 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.54 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.54 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.54 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.54 |
| ▸ | FAAH | O00519 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL7851490 | 0.90 | HTT (0.88) | HPGDHTTRECQLBCHEACHE | |
| SCHEMBL7847683 | 0.85 | HPGD (0.79) | HPGDHTTRECQLBCHEACHE | |
| SCHEMBL23575950 | 0.82 | HPGD (0.75) | HPGDHTTRECQLBCHEACHE | |
| SCHEMBL19710020 | 0.82 | HPGD (0.75) | HPGDHTTRECQLBCHEACHE | |
| SCHEMBL7846913 | 0.82 | HPGD (0.74) | HPGDHTTRECQLBCHEACHE | |
| SCHEMBL7847606 | 0.82 | HPGD (0.70) | HPGDHTTRECQLBCHEACHE | |
| SCHEMBL13176318 | 0.80 | HPGD (0.70) | HPGDHTTRECQLBCHEACHE | |
| SCHEMBL12371556 | 0.80 | MAPT (0.78) | HPGDHTTRECQLMAPTALDH1A1 | |
| SCHEMBL19710653 | 0.79 | HPGD (0.69) | HPGDHTTRECQLBCHEACHE | |
| SCHEMBL21489920 | 0.79 | HPGD (0.69) | HPGDHTTRECQLBCHEACHE |
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-1140914-A1 | NON-PEPTIDE NK1 RECEPTORS ANTAGONISTS | WARNER-LAMBERT COMPANY (US) | 2001-10-10 | — | — | EP | disclosed |
| WO-2000037462-A1 | NON-PEPTIDE NK1 RECEPTORS ANTAGONISTS | WARNER-LAMBERT COMPANY (US) | 2000-06-29 | — | — | WO | disclosed |