Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK2 | O75116 | 8/20 | 0.38 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.38 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | ESR1 | P03372 | 1/20 | 0.35 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | ELANE | P08246 | 1/20 | 0.35 |
| ▸ | KDM5A | P29375 | 1/20 | 0.34 |
| ▸ | ATM | Q13315 | 1/20 | 0.34 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.34 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.33 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.33 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.33 |
| ▸ | EGFR | P00533 | 1/20 | 0.33 |
| ▸ | SRC | P12931 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL29856503 | 0.84 | ADORA3 (0.44) | ROCK2ADORA3ADORA2AMAPTESR1 | |
| SCHEMBL29856173 | 0.83 | ADORA3 (0.40) | ROCK2ADORA3ADORA2AMAPTESR1 | |
| SCHEMBL29856267 | 0.81 | SRD5A2 (0.46) | ROCK2MAPTHTTCYP19A1EGFR | |
| SCHEMBL29856230 | 0.80 | ROCK2 (0.42) | ROCK2ADORA3ADORA2AMAPTESR1 | |
| SCHEMBL29856214 | 0.80 | KDM5A (0.40) | ROCK2ADORA3ADORA2AMAPTESR1 | |
| SCHEMBL29856274 | 0.78 | ROCK2 (0.36) | ROCK2ADORA3ADORA2AMAPTESR1 | |
| SCHEMBL29856145 | 0.72 | POLB (0.51) | MAPTESR1ESR2LMNAPKM | |
| SCHEMBL29856192 | 0.71 | KDM5A (0.50) | ROCK2MAPTHTTKDM5ASLC22A12 | |
| SCHEMBL29856233 | 0.70 | ERN1 (0.39) | ROCK2ADORA3ADORA2AMAPTLMNA | |
| SCHEMBL29856217 | 0.69 | TUBB4A (0.41) | MAPTESR1ESR2LMNAPKM |
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 |