Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GLS | O94925 | 11/20 | 0.77 |
| ▸ | MAPT | P10636 | 3/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.59 |
| ▸ | NPC1 | O15118 | 4/20 | 0.58 |
| ▸ | RAB9A | P51151 | 4/20 | 0.58 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.58 |
| ▸ | GAA | P10253 | 2/20 | 0.52 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.52 |
| ▸ | LMNA | P02545 | 3/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | POLB | P06746 | 1/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | HTT | P42858 | 1/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | HPGD | P15428 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL14987378 | 0.88 | GLS (1.00) | GLSMAPTALDH1A1NPC1RAB9A | |
| SCHEMBL21368901 | 0.85 | GLS (0.77) | GLSMAPTALDH1A1 | |
| SCHEMBL21369012 | 0.79 | GLS (0.74) | GLSALDH1A1RAB9ASMN1; SMN2NPSR1 | |
| SCHEMBL14987419 | 0.79 | GLS (1.00) | GLSMAPTALDH1A1NPC1RAB9A | |
| SCHEMBL21368900 | 0.78 | GLS (0.74) | GLSMAPTALDH1A1NPC1RAB9A | |
| SCHEMBL14987415 | 0.74 | GLS (1.00) | GLSMAPTALDH1A1NPC1RAB9A | |
| SCHEMBL14987022 | 0.73 | GLS (1.00) | GLS | |
| SCHEMBL22623433 | 0.73 | GLS (0.76) | GLS | |
| SCHEMBL14987142 | 0.72 | GLS (1.00) | GLSMAPTALDH1A1LMNA | |
| SCHEMBL14987435 | 0.71 | GLS (0.52) | GLS |
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-2782570-B1 | HETEROCYCLIC INHIBITORS OF GLUTAMINASE | CALITHERA BIOSCIENCES INC (US) | 2019-09-18 | — | — | EP | disclosed |