Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.47 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.47 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.47 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.44 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.44 |
| ▸ | APP | P05067 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 3/20 | 0.42 |
| ▸ | RAB9A | P51151 | 3/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | MAOB | P27338 | 3/20 | 0.41 |
| ▸ | MAOA | P21397 | 1/20 | 0.41 |
| ▸ | KIF11 | P52732 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL9348226 | 0.91 | ALDH1A1 (0.54) | ALDH1A1KDM4EMTNR1AMTNR1BHRH3 | |
| SCHEMBL2153559 | 0.85 | ALDH1A1 (0.53) | ALDH1A1KDM4EMTNR1AMTNR1BHRH3 | |
| SCHEMBL10820381 | 0.84 | ALDH1A1 (0.49) | ALDH1A1KDM4EMTNR1AMTNR1BHRH3 | |
| SCHEMBL18557906 | 0.84 | ALDH1A1 (0.49) | ALDH1A1KDM4EMTNR1AMTNR1BHRH3 | |
| SCHEMBL10345730 | 0.83 | ALDH1A1 (0.51) | ALDH1A1KDM4EMTNR1AMTNR1BHRH3 | |
| Hydrochloric Acid SCHEMBL3402934 | 0.83 | ALDH1A1 (0.56) | ALDH1A1KDM4EMTNR1AMTNR1BHRH3 | |
| SCHEMBL6512056 | 0.82 | MTNR1A (0.51) | ALDH1A1KDM4EMTNR1AMTNR1BHRH3 | |
| SCHEMBL9344644 | 0.81 | ALDH1A1 (0.50) | ALDH1A1KDM4EMTNR1AMTNR1BHRH3 | |
| SCHEMBL21102314 | 0.81 | DYRK3 (0.53) | ALDH1A1KDM4EMTNR1AMTNR1BHRH3 | |
| SCHEMBL418525 | 0.80 | ALDH1A1 (0.59) | ALDH1A1KDM4EMTNR1AMTNR1BHRH3 |
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 |
|---|---|---|---|---|---|---|---|
| US-6255323-B1 | Cyanoguanidine compounds | SHIONOGI BIORESEARCH CORP. | 2001-07-03 | — | — | US | disclosed |
| WO-2000061561-A1 | CYANOGUANIDINE COMPOUNDS | SHIONOGI BIORESEARCH CORP. (US) | 2000-10-19 | — | — | WO | disclosed |