Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 1/20 | 0.34 |
| ▸ | CA1 | P00915 | 1/20 | 0.34 |
| ▸ | CA2 | P00918 | 1/20 | 0.34 |
| ▸ | CA4 | P22748 | 1/20 | 0.34 |
| ▸ | CA7 | P43166 | 1/20 | 0.34 |
| ▸ | CA9 | Q16790 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.32 |
| ▸ | RAB9A | P51151 | 3/20 | 0.32 |
| ▸ | HTT | P42858 | 3/20 | 0.32 |
| ▸ | NPC1 | O15118 | 2/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.32 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.32 |
| ▸ | TAS1R2 | Q8TE23 | 1/20 | 0.32 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL20590204 | 1.00 | CA12 (0.34) | CA12CA1CA2CA4CA7 | |
| SCHEMBL30856816 | 0.79 | CA12 (0.33) | CA12CA1CA2CA4CA7 | |
| SCHEMBL19866089 | 0.79 | CA12 (0.33) | CA12CA1CA2CA4CA7 | |
| SCHEMBL16555544 | 0.78 | ALDH1A1 (0.35) | MEN1KMT2AALDH1A1HTTL3MBTL1 | |
| SCHEMBL16555734 | 0.73 | RECQL (0.41) | ALDH1A1 | |
| SCHEMBL8090040 | 0.72 | TRPV4 (0.39) | MEN1KMT2AGAAALDH1A1HTT | |
| SCHEMBL17192918 | 0.69 | TRPV4 (0.37) | MEN1KMT2AGAAALDH1A1HTT | |
| SCHEMBL16122042 | 0.67 | TRPV4 (0.41) | L3MBTL1 | |
| SCHEMBL14720211 | 0.67 | GSK3B (0.40) | MEN1KMT2AGAAALDH1A1RAB9A | |
| SCHEMBL16555403 | 0.66 | TRPV4 (0.43) | MEN1KMT2AGAAALDH1A1HTT |
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-RE49948-E1 | Aryl ethers and uses thereof | PELOTON THERAPEUTICS, INC. (US) | 2024-04-30 | — | — | US | disclosed |