Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 4/20 | 0.48 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.44 |
| ▸ | NPC1 | O15118 | 3/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.42 |
| ▸ | RAB9A | P51151 | 2/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.42 |
| ▸ | DCTPP1 | Q9H773 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 3/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.42 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | SLC29A1 | Q99808 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | MMP1 | P03956 | 1/20 | 0.40 |
| ▸ | MMP2 | P08253 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL9833207 | 0.82 | HPGD (0.53) | HPGDPTPN1ALDH1A1NPC1SMN1; SMN2 | |
| SCHEMBL10831867 | 0.81 | HPGD (0.55) | HPGDPTPN1ALDH1A1NPC1SMN1; SMN2 | |
| SCHEMBL8996846 | 0.79 | SMN1; SMN2 (0.51) | HPGDPTPN1ALDH1A1NPC1SMN1; SMN2 | |
| SCHEMBL7398084 | 0.76 | ALDH1A1 (0.49) | HPGDALDH1A1NPC1SMN1; SMN2RAB9A | |
| SCHEMBL9831716 | 0.74 | CACNA1C (0.69) | HPGDALDH1A1SMN1; SMN2MAPK1KMT2A | |
| SCHEMBL5795803 | 0.72 | KMT2A (0.71) | HPGDPTPN1ALDH1A1NPC1SMN1; SMN2 | |
| SCHEMBL3825495 | 0.72 | PTPN1 (0.67) | HPGDPTPN1ALDH1A1NPC1SMN1; SMN2 | |
| SCHEMBL5201436 | 0.71 | ALDH1A1 (0.47) | HPGDPTPN1ALDH1A1NPC1SMN1; SMN2 | |
| SCHEMBL31347487 | 0.71 | ALDH1A1 (0.47) | HPGDPTPN1ALDH1A1NPC1SMN1; SMN2 | |
| SCHEMBL8349572 | 0.70 | ALDH1A1 (0.44) | HPGDALDH1A1NPC1SMN1; SMN2RAB9A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0163238-B1 | SUBSTITUTED AND BRIDGED PYRIDINES USEFUL AS PHARMACEUTICAL AGENTS | MERCK & CO. INC. (US) | 1991-07-24 | — | — | EP | disclosed |
| US-4579851-A | HYPOTENSIVE, ANTIARRHYTHMIA AGENTS | MERCK & CO., INC. (US) | 1986-04-01 | — | — | US | disclosed |
| EP-0163238-A2 | Substituted and bridged pyridines useful as pharmaceutical agents | MERCK & CO. INC. (US) | 1985-12-04 | — | — | EP | disclosed |