Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 8/20 | 0.38 |
| ▸ | GLS | O94925 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 4/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | HPGD | P15428 | 3/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 3/20 | 0.35 |
| ▸ | NPC1 | O15118 | 3/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL21368902 | 0.74 | GLS (0.43) | GLS | |
| SCHEMBL21369012 | 0.69 | GLS (0.74) | ALDH1A1SMN1; SMN2GLSRAB9AHSD17B10 | |
| SCHEMBL14987103 | 0.56 | GLS (1.00) | ALDH1A1SMN1; SMN2GLSRAB9AHSD17B10 | |
| SCHEMBL8562439 | 0.56 | HPGD (0.49) | ALDH1A1SMN1; SMN2RAB9AHSD17B10HPGD | |
| SCHEMBL14987102 | 0.54 | GLS (1.00) | ALDH1A1SMN1; SMN2GLSRAB9AHSD17B10 | |
| SCHEMBL3270695 | 0.53 | TSHR (0.51) | ALDH1A1SMN1; SMN2RAB9AHSD17B10TSHR | |
| SCHEMBL21941834 | 0.53 | TSHR (0.51) | ALDH1A1SMN1; SMN2RAB9AHSD17B10TSHR | |
| SCHEMBL24177180 | 0.52 | HPGD (0.62) | ALDH1A1SMN1; SMN2RAB9AHSD17B10TSHR | |
| SCHEMBL21941760 | 0.52 | HPGD (0.62) | ALDH1A1SMN1; SMN2RAB9AHSD17B10TSHR | |
| SCHEMBL10084268 | 0.52 | HSD17B10 (0.64) | ALDH1A1SMN1; SMN2RAB9AHSD17B10HPGD |
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 |