Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GLS | O94925 | 9/20 | 0.65 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.61 |
| ▸ | NPC1 | O15118 | 1/20 | 0.61 |
| ▸ | RAB9A | P51151 | 1/20 | 0.61 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.61 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.61 |
| ▸ | MEN1 | O00255 | 3/20 | 0.60 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.60 |
| ▸ | TSHR | P16473 | 1/20 | 0.55 |
| ▸ | HPGD | P15428 | 1/20 | 0.54 |
| ▸ | TP53 | P04637 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL15725013 | 1.00 | GLS (0.65) | GLSALDH1A1NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL15725103 | 1.00 | GLS (0.65) | GLSALDH1A1NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL15709890 | 0.92 | GLS (0.58) | GLSALDH1A1NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL15725101 | 0.89 | ALDH1A1 (0.64) | GLSALDH1A1NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL15725005 | 0.89 | ALDH1A1 (0.64) | GLSALDH1A1NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL15725037 | 0.85 | GLS (0.61) | GLSALDH1A1NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL20825378 | 0.85 | ALDH1A1 (0.62) | GLSALDH1A1NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL15725040 | 0.85 | GLS (0.61) | GLSALDH1A1NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL15725109 | 0.84 | ALDH1A1 (0.75) | GLSALDH1A1NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL15725018 | 0.84 | ALDH1A1 (0.75) | GLSALDH1A1NPC1RAB9ASMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3456719-A1 | COMPOUNDS AND THEIR METHODS OF USE | Agios Pharmaceuticals, Inc. (US) | 2019-03-20 | — | — | EP | disclosed |