Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | SRD5A1 | P18405 | 1/20 | 0.39 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 4/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.38 |
| ▸ | MAPT | P10636 | 3/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | NOS1 | P29475 | 2/20 | 0.37 |
| ▸ | NOS2 | P35228 | 2/20 | 0.37 |
| ▸ | TRPA1 | O75762 | 3/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | MAOA | P21397 | 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 | |
|---|---|---|---|---|
| SCHEMBL7764535 | 1.00 | ALDH1A1 (0.41) | ALDH1A1SRD5A1SRD5A2MEN1KMT2A | |
| SCHEMBL546334 | 0.83 | NOS1 (0.48) | ALDH1A1CYP2D6NOS1NOS2HSD17B10 | |
| SCHEMBL3115176 | 0.83 | NOS1 (0.48) | ALDH1A1CYP2D6NOS1NOS2HSD17B10 | |
| SCHEMBL4751341 | 0.83 | NOS1 (0.48) | ALDH1A1CYP2D6NOS1NOS2HSD17B10 | |
| SCHEMBL186274 | 0.77 | NOS1 (0.52) | ALDH1A1MEN1KMT2ACYP2D6NOS1 | |
| SCHEMBL8542775 | 0.76 | NOS1 (0.50) | ALDH1A1MEN1KMT2ACYP2D6NOS1 | |
| SCHEMBL3173918 | 0.76 | NOS1 (0.50) | ALDH1A1MEN1KMT2ACYP2D6NOS1 | |
| SCHEMBL5537503 | 0.72 | CYP19A1 (0.36) | ALDH1A1MAPTTDP1TSHR | |
| SCHEMBL10379980 | 0.72 | KDM1A (0.42) | NOS2TRPA1TDP1 | |
| SCHEMBL8004698 | 0.72 | ESR2 (0.41) | CYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2001091796-A2 | METHODS, COMPOUNDS AND COMPOSITIONS FOR TREATING GOUT | GUILFORD PHARMACEUTICALS INC. (US) | 2001-12-06 | — | — | WO | disclosed |