Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | HDAC2 | Q92769 | 4/20 | 0.36 |
| ▸ | PTK2 | Q05397 | 3/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.36 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.36 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.36 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | GLA | P06280 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.32 |
| ▸ | HPGD | P15428 | 2/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.31 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 3/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL7007914 | 0.78 | GRM2 (0.37) | NPC1ALDH1A1RAB9AGAAGRM2 | |
| SCHEMBL7007419 | 0.74 | GRM2 (0.33) | GRM2TSHR | |
| SCHEMBL7805159 | 0.73 | NPC1 (0.44) | NPC1KMT2AMAPTMAPK1ALDH1A1 | |
| SCHEMBL7009360 | 0.73 | SMN1; SMN2 (0.47) | NPC1KMT2AALDH1A1HPGDRAB9A | |
| SCHEMBL7011855 | 0.71 | HSD17B10 (0.43) | KMT2AMAPTALDH1A1HPGDPOLB | |
| SCHEMBL7009366 | 0.71 | GRM2 (0.35) | NPC1ALDH1A1RAB9AGAAGRM2 | |
| SCHEMBL7009338 | 0.71 | CYP1A2 (0.43) | KMT2AMAPTALDH1A1HPGDGRM2 | |
| SCHEMBL10637850 | 0.69 | GAA (0.48) | NPC1KMT2AMAPTGLAMAPK1 | |
| SCHEMBL7011246 | 0.69 | ALDH1A1 (0.46) | KMT2AMAPK1ALDH1A1HPGDTSHR | |
| SCHEMBL9054906 | 0.69 | MAPT (0.37) | NPC1KMT2AMAPTALDH1A1HPGD |
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-0772593-B1 | THIOPYRIDYL COMPOUNDS FOR CONTROLLING HELICOBACTER BACTERIA | ALTANA PHARMA AG (DE) | 2003-05-02 | — | — | EP | disclosed |
| US-6162809-A | Pyridylthio compounds for controlling helicobacter bacteria | BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) | 2000-12-19 | — | — | US | disclosed |