Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | CAD | P27708 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.39 |
| ▸ | GRIK1 | P39086 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 2/20 | 0.37 |
| ▸ | MGAM | O43451 | 1/20 | 0.37 |
| ▸ | SI | P14410 | 1/20 | 0.37 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.37 |
| ▸ | SOAT1 | P35610 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL11298056 | 1.00 | ALDH1A1 (0.44) | ALDH1A1LMNAHSD17B10ALOX15CYP2D6 | |
| Hydrochloric Acid SCHEMBL22615898 | 0.98 | ALDH1A1 (0.42) | ALDH1A1LMNAHSD17B10ALOX15CYP2D6 | |
| SCHEMBL14016339 | 0.83 | ALOX15 (0.48) | ALDH1A1LMNAHSD17B10ALOX15CYP2D6 | |
| SCHEMBL15345315 | 0.83 | ALDH1A1 (0.36) | ALDH1A1LMNAHSD17B10TDP1GRIK1 | |
| SCHEMBL15298839 | 0.83 | ALDH1A1 (0.41) | ALDH1A1LMNAHSD17B10ALOX15CYP2D6 | |
| SCHEMBL15299749 | 0.83 | ALDH1A1 (0.41) | ALDH1A1LMNAHSD17B10ALOX15CYP2D6 | |
| SCHEMBL1872921 | 0.83 | ALDH1A1 (0.41) | ALDH1A1LMNAHSD17B10ALOX15CYP2D6 | |
| SCHEMBL1172846 | 0.82 | MGAM (0.48) | ALDH1A1LMNAHSD17B10ALOX15CYP2D6 | |
| SCHEMBL1172849 | 0.82 | MGAM (0.48) | ALDH1A1LMNAHSD17B10ALOX15CYP2D6 | |
| SCHEMBL1178957 | 0.82 | ALOX15 (0.48) | ALDH1A1LMNAHSD17B10ALOX15CYP2D6 |
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 |