Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.40 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.39 |
| ▸ | HTR1A | P08908 | 1/20 | 0.38 |
| ▸ | HTR7 | P34969 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 3/20 | 0.36 |
| ▸ | RAB9A | P51151 | 3/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | TP53 | P04637 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | RAD51 | Q06609 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.34 |
| ▸ | GSK3B | P49841 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | CASP3 | P42574 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.34 |
| ▸ | SENP7 | Q9BQF6 | 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 | |
|---|---|---|---|---|
| SCHEMBL8399433 | 0.86 | ALDH1A1 (0.41) | ALDH1A1NPC1RAB9AGAASMN1; SMN2 | |
| SCHEMBL8402601 | 0.81 | ALDH1A1 (0.40) | ALDH1A1NPC1RAB9AGAASMN1; SMN2 | |
| SCHEMBL8403511 | 0.79 | L3MBTL1 (0.58) | ALDH1A1L3MBTL1MEN1KMT2A | |
| SCHEMBL8399558 | 0.79 | ALDH1A1 (0.39) | ALDH1A1GAASMN1; SMN2KDM4EMEN1 | |
| SCHEMBL8399521 | 0.78 | ALDH1A1 (0.42) | ALDH1A1NPC1RAB9AGAASMN1; SMN2 | |
| SCHEMBL8403524 | 0.77 | APLNR (0.45) | ALDH1A1MAPK1GAAAPLNR | |
| SCHEMBL8399369 | 0.76 | ALDH1A1 (0.38) | ALDH1A1NPC1RAB9AGAAKDM4E | |
| SCHEMBL8399519 | 0.74 | USP2 (0.37) | ALDH1A1NPC1RAB9AGAASMN1; SMN2 | |
| SCHEMBL8402756 | 0.73 | ALDH1A1 (0.55) | ALDH1A1SMN1; SMN2L3MBTL1MEN1KMT2A | |
| SCHEMBL8399362 | 0.67 | ALDH1A1 (0.47) | ALDH1A1NPC1RAB9AMAPK1GAA |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5885997-A | Heterocyclic compounds, process for their preparation and pharmaceutical compositions containing them and their use in the treatment of diabetes and related diseases | DR. REDDY'S RESEARCH FOUNDATION (IN) | 1999-03-23 | — | — | US | disclosed |