Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GLS | O94925 | 17/20 | 0.68 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 1/20 | 0.50 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL21368900 | 0.83 | GLS (0.74) | GLSALDH1A1MAPTNPC1RAB9A | |
| SCHEMBL14987416 | 0.83 | GLS (1.00) | GLSALDH1A1MAPTNPC1RAB9A | |
| SCHEMBL14987415 | 0.76 | GLS (1.00) | GLSALDH1A1MAPTNPC1RAB9A | |
| SCHEMBL14987545 | 0.70 | GLS (1.00) | GLSALDH1A1MAPTRAB9ASMN1; SMN2 | |
| SCHEMBL14987277 | 0.70 | GLS (1.00) | GLSALDH1A1MAPTNPC1RAB9A | |
| SCHEMBL14987536 | 0.69 | GLS (1.00) | GLSALDH1A1MAPT | |
| SCHEMBL14987419 | 0.69 | GLS (1.00) | GLSALDH1A1MAPTNPC1RAB9A | |
| SCHEMBL14987003 | 0.66 | GLS (1.00) | GLSALDH1A1MAPTNPC1RAB9A | |
| SCHEMBL18122467 | 0.66 | GLS (0.72) | GLS | |
| SCHEMBL18137164 | 0.66 | GLS (0.89) | GLSALDH1A1MAPT |
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-2013078123-A1 | HETEROCYCLIC INHIBITORS OF GLUTAMINASE | CALITHERA BIOSCIENCES INC. (US) | 2013-05-30 | — | — | WO | disclosed |