Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.56 |
| ▸ | NAMPT | P43490 | 5/20 | 0.53 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.52 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.52 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.52 |
| ▸ | MAPT | P10636 | 2/20 | 0.52 |
| ▸ | TP53 | P04637 | 1/20 | 0.52 |
| ▸ | GAA | P10253 | 1/20 | 0.52 |
| ▸ | LMNA | P02545 | 2/20 | 0.50 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.50 |
| ▸ | RPS6KA5 | O75582 | 1/20 | 0.50 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.50 |
| ▸ | PRKCG | P05129 | 1/20 | 0.50 |
| ▸ | PRKACA | P17612 | 1/20 | 0.50 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.50 |
| ▸ | AKT1 | P31749 | 1/20 | 0.50 |
| ▸ | GSK3A | P49840 | 1/20 | 0.50 |
| ▸ | GSK3B | P49841 | 1/20 | 0.50 |
| ▸ | PRKX | P51817 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL8525511 | 0.88 | NAMPT (0.57) | NAMPTHDAC2HDAC8HDAC6GAA | |
| SCHEMBL8395852 | 0.87 | MAPK1 (0.55) | ALDH1A1HDAC2HDAC8HDAC6TP53 | |
| SCHEMBL8524910 | 0.86 | NAMPT (0.64) | NAMPTRAB9A | |
| SCHEMBL8523428 | 0.85 | NAMPT (0.60) | NAMPTRAB9A | |
| SCHEMBL8392170 | 0.80 | NAMPT (0.43) | ALDH1A1NAMPTMAPTTP53ROCK2 | |
| Hydrochloric Acid SCHEMBL8582954 | 0.79 | ITGA4 (0.56) | ALDH1A1GAALMNAMEN1KMT2A | |
| SCHEMBL17744942 | 0.78 | HDAC6 (0.68) | NAMPTHDAC2HDAC8HDAC6MAPT | |
| Oxalic Acid SCHEMBL8392856 | 0.78 | HRH3 (0.42) | ALDH1A1NAMPTMAPTTP53ROCK2 | |
| SCHEMBL8524903 | 0.78 | NAMPT (0.67) | NAMPTMAPTTP53 | |
| SCHEMBL22145190 | 0.76 | ALDH1A1 (0.76) | ALDH1A1HDAC2HDAC8HDAC6MEN1 |
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-0690851-B1 | GUANIDINE DERIVATIVES USEFUL IN THERAPY | ASTRA AB (SE) | 1999-05-19 | — | — | EP | claimed |
| US-5885985-A | Guanidine derivatives useful in therapy | ASTRA AKTIEBOLAG (SE) | 1999-03-23 | — | — | US | claimed |