Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 10/20 | 0.56 |
| ▸ | HPGD | P15428 | 9/20 | 0.56 |
| ▸ | MAPT | P10636 | 5/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.56 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.56 |
| ▸ | GAA | P10253 | 2/20 | 0.56 |
| ▸ | RAB9A | P51151 | 2/20 | 0.56 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.56 |
| ▸ | GRM6 | O15303 | 5/20 | 0.52 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.52 |
| ▸ | TSHR | P16473 | 2/20 | 0.51 |
| ▸ | LMNA | P02545 | 1/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | NPC1 | O15118 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.49 |
| ▸ | TP53 | P04637 | 1/20 | 0.48 |
| ▸ | THRB | P10828 | 1/20 | 0.48 |
| ▸ | GSTO1 | P78417 | 1/20 | 0.47 |
| ▸ | CDC7 | O00311 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL20028742 | 0.85 | ALDH1A1 (0.58) | ALDH1A1HPGDMAPTSMN1; SMN2HSD17B10 | |
| SCHEMBL976420 | 0.84 | ALDH1A1 (0.72) | ALDH1A1HPGDMAPTSMN1; SMN2HSD17B10 | |
| SCHEMBL22897286 | 0.83 | GRM6 (0.59) | ALDH1A1HPGDMAPTSMN1; SMN2HSD17B10 | |
| SCHEMBL13398578 | 0.83 | GAA (0.58) | ALDH1A1HPGDMAPTSMN1; SMN2HSD17B10 | |
| SCHEMBL20028532 | 0.81 | HPGD (0.53) | ALDH1A1HPGDMAPTSMN1; SMN2HSD17B10 | |
| SCHEMBL13398635 | 0.81 | ALDH1A1 (0.53) | ALDH1A1HPGDMAPTSMN1; SMN2HSD17B10 | |
| SCHEMBL937896 | 0.77 | ALDH1A1 (0.71) | ALDH1A1HPGDMAPTSMN1; SMN2HSD17B10 | |
| SCHEMBL20269597 | 0.77 | GAA (0.49) | ALDH1A1HPGDMAPTSMN1; SMN2HSD17B10 | |
| SCHEMBL3100139 | 0.77 | GAA (0.49) | ALDH1A1HPGDMAPTSMN1; SMN2HSD17B10 | |
| SCHEMBL3609310 | 0.76 | TSHR (0.58) | ALDH1A1HPGDMAPTSMN1; SMN2HSD17B10 |
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-2018064119-A1 | CALPAIN MODULATORS AND THERAPEUTIC USES THEREOF | BLADE THERAPEUTICS, INC. (US) | 2018-04-05 | — | — | WO | disclosed |