Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | APLNR | P35414 | 5/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | HCAR1 | Q9BXC0 | 1/20 | 0.34 |
| ▸ | USP2 | O75604 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 2/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.32 |
| ▸ | BLM | P54132 | 1/20 | 0.32 |
| ▸ | PDE5A | O76074 | 1/20 | 0.31 |
| ▸ | PDE1A | P54750 | 1/20 | 0.31 |
| ▸ | PDE1B | Q01064 | 1/20 | 0.31 |
| ▸ | PDE1C | Q14123 | 1/20 | 0.31 |
| ▸ | BCAT2 | O15382 | 1/20 | 0.31 |
| ▸ | PKM | P14618 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL8403524 | 0.94 | APLNR (0.45) | ALDH1A1APLNRGAAMAPTCYP1A2 | |
| SCHEMBL8399433 | 0.92 | ALDH1A1 (0.41) | ALDH1A1APLNRGAAMAPTMEN1 | |
| SCHEMBL8402601 | 0.87 | ALDH1A1 (0.40) | ALDH1A1APLNRGAAKDM4EMAPT | |
| SCHEMBL8399521 | 0.86 | ALDH1A1 (0.42) | ALDH1A1APLNRGAAHCAR1MEN1 | |
| SCHEMBL8399519 | 0.80 | USP2 (0.37) | ALDH1A1APLNRGAAUSP2KDM4E | |
| SCHEMBL8401523 | 0.79 | ALDH1A1 (0.40) | ALDH1A1APLNRGAAKDM4EMEN1 | |
| SCHEMBL8399369 | 0.76 | ALDH1A1 (0.38) | ALDH1A1APLNRGAAKDM4EMEN1 | |
| SCHEMBL8399362 | 0.72 | ALDH1A1 (0.47) | ALDH1A1GAAMAPTMEN1KMT2A | |
| SCHEMBL8403511 | 0.72 | L3MBTL1 (0.58) | ALDH1A1MAPTMEN1KMT2ACYP1A2 | |
| SCHEMBL8402756 | 0.70 | ALDH1A1 (0.55) | ALDH1A1MAPTMEN1KMT2ASMN1; SMN2 |
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 |