Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | CCR2 | P41597 | 1/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.30 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
| ▸ | EDNRB | P24530 | 1/20 | 0.30 |
| ▸ | EDNRA | P25101 | 1/20 | 0.30 |
| ▸ | HTR6 | P50406 | 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 | |
|---|---|---|---|---|
| SCHEMBL8920824 | 0.85 | SLC40A1 (0.37) | ALDH1A1NPSR1RXFP1EDNRBEDNRA | |
| SCHEMBL8916155 | 0.84 | HTR6 (0.36) | ALDH1A1KMT2AHTR6 | |
| SCHEMBL8917696 | 0.80 | GAA (0.39) | ALDH1A1SMN1; SMN2KMT2AHTR6 | |
| SCHEMBL8918176 | 0.74 | CCR3 (0.36) | KMT2A | |
| SCHEMBL8918255 | 0.74 | PTGS2 (0.38) | — | |
| SCHEMBL8918039 | 0.74 | HSD17B1 (0.35) | ALDH1A1SMN1; SMN2KMT2A | |
| SCHEMBL8918357 | 0.73 | HPGD (0.37) | ALDH1A1KMT2A | |
| SCHEMBL8916300 | 0.73 | MEN1 (0.39) | SMN1; SMN2KMT2AHTR6 | |
| SCHEMBL8917789 | 0.73 | HTR6 (0.38) | ALDH1A1SMN1; SMN2KMT2AHTR6 | |
| SCHEMBL8917165 | 0.72 | CYP1A2 (0.31) | — |
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-5696143-A | ARTHRITIS THERAPY | G.D. SEARLE & CO. | 1997-12-09 | — | — | US | disclosed |