Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 4/20 | 0.52 |
| ▸ | RAB9A | P51151 | 4/20 | 0.52 |
| ▸ | LMNA | P02545 | 4/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.52 |
| ▸ | MAPT | P10636 | 3/20 | 0.52 |
| ▸ | TP53 | P04637 | 3/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.52 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.52 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.44 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.41 |
| ▸ | NUDT1 | P36639 | 1/20 | 0.41 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.40 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.40 |
| ▸ | RELA | Q04206 | 1/20 | 0.40 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.39 |
| ▸ | JAK2 | O60674 | 1/20 | 0.39 |
| ▸ | JAK3 | P52333 | 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 | |
|---|---|---|---|---|
| SCHEMBL5064225 | 0.85 | ALDH1A1 (0.52) | NPC1RAB9ALMNASMN1; SMN2ALDH1A1 | |
| SCHEMBL796470 | 0.80 | ROCK1 (0.51) | NPC1RAB9ALMNASMN1; SMN2ALDH1A1 | |
| SCHEMBL9004353 | 0.80 | NUDT1 (0.51) | NPC1RAB9ALMNASMN1; SMN2ALDH1A1 | |
| SCHEMBL9004357 | 0.80 | NPC1 (0.60) | NPC1RAB9ALMNASMN1; SMN2ALDH1A1 | |
| SCHEMBL5063173 | 0.77 | JAK2 (0.53) | NPC1RAB9ALMNASMN1; SMN2ALDH1A1 | |
| SCHEMBL17486069 | 0.77 | JAK2 (0.53) | NPC1RAB9ALMNASMN1; SMN2ALDH1A1 | |
| SCHEMBL5058811 | 0.77 | SMN1; SMN2 (0.46) | NPC1RAB9ALMNASMN1; SMN2ALDH1A1 | |
| SCHEMBL9377990 | 0.73 | NUDT1 (0.52) | NPC1RAB9ALMNASMN1; SMN2ALDH1A1 | |
| SCHEMBL17220118 | 0.72 | ALDH1A1 (0.61) | NPC1RAB9ALMNASMN1; SMN2ALDH1A1 | |
| SCHEMBL5063368 | 0.70 | ALDH1A1 (0.50) | NPC1RAB9ALMNASMN1; SMN2ALDH1A1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5574037-A | MODULATED BY SINO-ATRIAL NODE, ANTIISCHEMIC AGENT | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1996-11-12 | — | — | US | disclosed |
| EP-0431856-B1 | Heterocyclic compounds | ZENECA LTD (GB) | 1995-07-12 | — | — | EP | disclosed |
| US-5332737-A | Cardiovascular disorders | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1994-07-26 | — | — | US | disclosed |
| EP-0431856-A2 | Heterocyclic compounds | ZENECA LIMITED (GB) | 1991-06-12 | — | — | EP | disclosed |