Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 6/20 | 0.38 |
| ▸ | RAB9A | P51151 | 6/20 | 0.38 |
| ▸ | RECQL | P46063 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 12/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 12/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 8/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | GAA | P10253 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | RCE1 | Q9Y256 | 1/20 | 0.33 |
| ▸ | GLA | P06280 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL5772800 | 0.98 | NPC1 (0.37) | NPC1RAB9ARECQLALDH1A1KDM4E | |
| SCHEMBL22503036 | 0.81 | ALDH1A1 (0.38) | NPC1RAB9ARECQLALDH1A1KDM4E | |
| SCHEMBL5771074 | 0.81 | CCR1 (0.38) | NPC1RAB9ARECQLALDH1A1KDM4E | |
| SCHEMBL6217690 | 0.77 | HPGD (0.41) | NPC1RAB9ARECQLALDH1A1KDM4E | |
| SCHEMBL19817523 | 0.77 | ALDH1A1 (0.35) | NPC1RAB9ARECQLALDH1A1KDM4E | |
| SCHEMBL2053853 | 0.74 | KCNH2 (0.47) | NPC1RAB9AALDH1A1KDM4EPKM | |
| SCHEMBL5808966 | 0.74 | RAB9A (0.39) | NPC1RAB9ARECQLALDH1A1KDM4E | |
| SCHEMBL2813856 | 0.72 | KDM4E (0.58) | NPC1RAB9ARECQLALDH1A1KDM4E | |
| Hydrochloric Acid SCHEMBL260050 | 0.70 | KDM4E (0.56) | NPC1RAB9ARECQLALDH1A1KDM4E | |
| SCHEMBL2398490 | 0.69 | NUDT1 (0.40) | NPC1RAB9AALDH1A1KDM4EHPGD |
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-1383768-B1 | IMIDAZO-PYRIMIDINE DERIVATIVES AS LIGANDS FOR GABA RECEPTORS | MERCK SHARP & DOHME (GB) | 2006-09-06 | — | — | EP | disclosed |