Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 2/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.36 |
| ▸ | MGAM | O43451 | 1/20 | 0.36 |
| ▸ | SI | P14410 | 1/20 | 0.36 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.36 |
| ▸ | SOAT1 | P35610 | 1/20 | 0.36 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.35 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.35 |
| ▸ | METAP2 | P50579 | 4/20 | 0.35 |
| ▸ | METAP1 | P53582 | 4/20 | 0.35 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL12707546 | 0.82 | ALDH1A1 (0.42) | ALDH1A1CYP3A4CYP2C19HSD17B10LMNA | |
| SCHEMBL31065468 | 0.82 | METAP2 (0.42) | ALDH1A1CYP3A4CYP2C19HSD17B10LMNA | |
| SCHEMBL12707543 | 0.82 | ALDH1A1 (0.42) | ALDH1A1CYP3A4CYP2C19HSD17B10LMNA | |
| SCHEMBL16626926 | 0.82 | ALDH1A1 (0.42) | ALDH1A1CYP3A4CYP2C19HSD17B10LMNA | |
| SCHEMBL12934328 | 0.78 | METAP2 (0.40) | ALDH1A1CYP3A4CYP2C19HSD17B10LMNA | |
| SCHEMBL3671186 | 0.78 | METAP2 (0.43) | ALDH1A1CYP3A4CYP2C19HSD17B10LMNA | |
| SCHEMBL818946 | 0.77 | MME (0.41) | ALDH1A1CYP3A4CYP2C19HSD17B10LMNA | |
| SCHEMBL14068860 | 0.77 | ALOX15 (0.39) | ALDH1A1CYP2C19HSD17B10LMNAGAA | |
| SCHEMBL18113296 | 0.77 | ALDH1A1 (0.37) | ALDH1A1CYP3A4CYP2C19HSD17B10LMNA | |
| SCHEMBL280605 | 0.74 | — | — |
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-2141995-B1 | COMPOSITIONS AND THEIR USES IN PROTECTING CELLS FROM TOXIC EXPOSURES | PERSCITUS BIOSCIENCES LLC (US) | 2014-11-05 | — | — | EP | disclosed |