Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.48 |
| ▸ | PKM | P14618 | 3/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | HTT | P42858 | 1/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | ACHE | P22303 | 1/20 | 0.44 |
| ▸ | USP2 | O75604 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.42 |
| ▸ | MCOLN3 | Q8TDD5 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL23406562 | 0.77 | PKM (0.44) | ALDH1A1PKMPOLBHTTKMT2A | |
| SCHEMBL11781009 | 0.75 | ALDH1A1 (0.40) | ALDH1A1PKMPOLBHTTKDM4E | |
| SCHEMBL9066501 | 0.74 | PKM (0.46) | ALDH1A1PKMPOLBHTTKMT2A | |
| SCHEMBL9066505 | 0.74 | PKM (0.46) | ALDH1A1PKMPOLBHTTKMT2A | |
| SCHEMBL7849121 | 0.74 | GAA (0.47) | ALDH1A1PKMPOLBHTTACHE | |
| SCHEMBL9066820 | 0.74 | GAA (0.47) | ALDH1A1PKMPOLBHTTACHE | |
| SCHEMBL9067810 | 0.73 | PKM (0.45) | ALDH1A1PKMPOLBHTTKMT2A | |
| SCHEMBL9066498 | 0.73 | PKM (0.45) | ALDH1A1PKMPOLBHTTLMNA | |
| SCHEMBL9068004 | 0.73 | PKM (0.45) | ALDH1A1PKMPOLBHTTKMT2A | |
| SCHEMBL9067095 | 0.73 | PKM (0.45) | ALDH1A1PKMPOLBHTTLMNA |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3810615-A1 | ARGINASE INHIBITORS AND METHODS OF USE | Merck Sharp & Dohme Corp. (US) | 2021-04-28 | — | — | EP | disclosed |
| WO-2019245890-A1 | ARGINASE INHIBITORS AND METHODS OF USE | MERCK SHARP & DOHME CORP. (US) | 2019-12-26 | — | — | WO | disclosed |