Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.44 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.44 |
| ▸ | ROCK2 | O75116 | 6/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | HTT | P42858 | 3/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | ESR1 | P03372 | 1/20 | 0.39 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | EYA3 | Q99504 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | ATM | Q13315 | 1/20 | 0.36 |
| ▸ | USP14 | P54578 | 1/20 | 0.36 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL29856230 | 0.84 | ROCK2 (0.42) | ADORA3ADORA2AROCK2MAPTHTT | |
| SCHEMBL29856340 | 0.84 | ROCK2 (0.38) | ADORA3ADORA2AROCK2MAPTHTT | |
| SCHEMBL29856214 | 0.84 | KDM5A (0.40) | ADORA3ADORA2AROCK2MAPTHTT | |
| SCHEMBL29856274 | 0.82 | ROCK2 (0.36) | ADORA3ADORA2AROCK2MAPTHTT | |
| SCHEMBL29856228 | 0.81 | ADORA3 (0.46) | ADORA3ADORA2AROCK2MAPTHTT | |
| SCHEMBL1288011 | 0.79 | SRC (0.55) | MAPTHTTHPGDLMNACYP2C19 | |
| SCHEMBL25942232 | 0.76 | ALDH1A1 (0.51) | MAPTHPGDLMNAPKMCYP2C19 | |
| SCHEMBL29856145 | 0.76 | POLB (0.51) | MAPTHTTHPGDESR1ESR2 | |
| SCHEMBL29856192 | 0.75 | KDM5A (0.50) | ROCK2MAPTHTTEYA3CYP19A1 | |
| SCHEMBL29856217 | 0.73 | TUBB4A (0.41) | MAPTHTTHPGDESR1ESR2 |
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-2022169974-A1 | INHIBITORS OF URAT1 AND PHARMACEUTICAL USES THEREOF | NEXYS THERAPEUTICS, INC. (US) | 2022-08-11 | — | — | WO | disclosed |