Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 5/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.45 |
| ▸ | NPC1 | O15118 | 4/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 3/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.44 |
| ▸ | MAOA | P21397 | 1/20 | 0.37 |
| ▸ | MAOB | P27338 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 3/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | CASP1 | P29466 | 1/20 | 0.33 |
| ▸ | CASP7 | P55210 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | PPARG | P37231 | 1/20 | 0.32 |
| ▸ | CCR6 | P51684 | 1/20 | 0.32 |
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 | 0.92 | ALDH1A1 (0.41) | RAB9AALDH1A1NPC1SMN1; SMN2MAPK1 | |
| SCHEMBL11049778 | 0.92 | ALDH1A1 (0.41) | RAB9AALDH1A1NPC1SMN1; SMN2MAPK1 | |
| SCHEMBL11049811 | 0.90 | MAPK1 (0.41) | RAB9AALDH1A1NPC1SMN1; SMN2MAPK1 | |
| SCHEMBL11049789 | 0.90 | NPC1 (0.42) | RAB9AALDH1A1NPC1SMN1; SMN2MAPK1 | |
| SCHEMBL11052394 | 0.90 | NPC1 (0.40) | RAB9AALDH1A1NPC1SMN1; SMN2MAPK1 | |
| SCHEMBL11263137 | 0.90 | ALDH1A1 (0.45) | RAB9AALDH1A1NPC1SMN1; SMN2MAPK1 | |
| SCHEMBL11054286 | 0.88 | HTT (0.43) | RAB9AALDH1A1NPC1SMN1; SMN2MAPK1 | |
| SCHEMBL11052848 | 0.87 | ALDH1A1 (0.43) | RAB9AALDH1A1NPC1SMN1; SMN2MAPK1 | |
| SCHEMBL11049751 | 0.85 | HTT (0.43) | RAB9AALDH1A1NPC1SMN1; SMN2MAPK1 | |
| SCHEMBL11054793 | 0.85 | NPC1 (0.44) | RAB9AALDH1A1NPC1SMN1; SMN2MAPK1 |
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 |
|---|---|---|---|---|---|---|---|
| US-4488993-A | Amidinoureas | WILLIAM H. RORER, INC. | 1984-12-18 | — | — | 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 |