Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.43 |
| ▸ | NPC1 | O15118 | 2/20 | 0.43 |
| ▸ | RAB9A | P51151 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | LCK | P06239 | 5/20 | 0.39 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.39 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.39 |
| ▸ | TAS1R2 | Q8TE23 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | IDH1 | O75874 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL11254493 | 0.93 | ALDH1A1 (0.41) | ALDH1A1NPC1RAB9AMEN1KMT2A | |
| SCHEMBL11049578 | 0.87 | RAB9A (0.45) | ALDH1A1NPC1RAB9AMEN1KMT2A | |
| SCHEMBL11049566 | 0.87 | LCK (0.40) | ALDH1A1NPC1RAB9AMEN1KMT2A | |
| SCHEMBL11048657 | 0.85 | HTT (0.47) | ALDH1A1NPC1RAB9AMEN1KMT2A | |
| SCHEMBL11049998 | 0.84 | MAPT (0.39) | ALDH1A1RAB9AMEN1KMT2AHPGD | |
| SCHEMBL11049751 | 0.84 | HTT (0.43) | ALDH1A1NPC1RAB9AMEN1KMT2A | |
| SCHEMBL11263137 | 0.82 | ALDH1A1 (0.45) | ALDH1A1NPC1RAB9AMEN1KMT2A | |
| SCHEMBL11052129 | 0.82 | POLB (0.46) | ALDH1A1RAB9AMEN1KMT2ALCK | |
| SCHEMBL11056203 | 0.82 | NPC1 (0.49) | ALDH1A1NPC1RAB9AMEN1KMT2A | |
| SCHEMBL11049778 | 0.82 | ALDH1A1 (0.41) | ALDH1A1NPC1RAB9AMEN1KMT2A |
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-4488993-A | Amidinoureas | WILLIAM H. RORER, INC. | 1984-12-18 | — | — | US | disclosed |
| US-4326074-A | ANTIDIARRHEA AGENTS | WILLIAM H. RORER, INC. (US) | 1982-04-20 | — | — | US | disclosed |
| US-4220658-A | Treatment of hypertension with amidinoureas | WILLIAM H. RORER, INC. (US) | 1980-09-02 | — | — | US | disclosed |
| US-4088785-A | HYPOTENSIVE AGENTS | WILLIAM H. RORER, INC. (US) | 1978-05-09 | — | — | US | disclosed |