Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TKT | P29401 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.33 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.32 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.32 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.30 |
| ▸ | PDE10A | Q9Y233 | 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 | |
|---|---|---|---|---|
| SCHEMBL485877 | 0.83 | HDAC4 (0.35) | TKTHDAC4GRM2OPRL1PDE10A | |
| SCHEMBL18397055 | 0.79 | TDP1 (0.33) | TDP1HDAC4OPRL1PDE10A | |
| SCHEMBL27973605 | 0.79 | LOXL2 (0.35) | TKTOPRL1KDM4EALDH1A1 | |
| SCHEMBL22092272 | 0.75 | MEN1 (0.40) | TDP1CA2KDM4EFFAR4MEN1 | |
| SCHEMBL20581874 | 0.75 | ALDH1A1 (0.39) | HDAC4OPRL1KDM4EALDH1A1PDE10A | |
| SCHEMBL23094533 | 0.74 | PDE10A (0.34) | HDAC4GRM2OPRL1PDE10A | |
| SCHEMBL12523394 | 0.74 | PDE8B (0.36) | HDAC4OPRL1KDM4EPDE10A | |
| SCHEMBL25252180 | 0.74 | OPRL1 (0.33) | HDAC4OPRL1PDE10A | |
| Hydrochloric Acid SCHEMBL20581875 | 0.73 | ALDH1A1 (0.38) | HDAC4OPRL1KDM4EALDH1A1PDE10A | |
| SCHEMBL20582080 | 0.71 | HDAC4 (0.33) | HDAC4GRM2OPRL1PDE10A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2023125681-A1 | HETEROCYCLIC COMPOUNDS | BEIGENE, LTD. (KY) | 2023-07-06 | — | — | WO | disclosed |
| EP-3634964-A1 | PYRAZOLOPYRIMIDINE PDE9 INHIBITORS | Merck Sharp & Dohme Corp. (US) | 2020-04-15 | — | — | EP | disclosed |
| WO-2018226771-A1 | PYRAZOLOPYRIMIDINE PDE9 INHIBITORS | MERCK SHARP & DOHME CORP. (US) | 2018-12-13 | — | — | WO | disclosed |