Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.52 |
| ▸ | TP53 | P04637 | 1/20 | 0.52 |
| ▸ | TSHR | P16473 | 2/20 | 0.48 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.31 |
| ▸ | CPT2 | P23786 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL28668441 | 0.92 | ALDH1A1 (0.52) | ALDH1A1TP53TSHRFFAR1CPT2 | |
| SCHEMBL81402 | 0.90 | ALDH1A1 (0.56) | ALDH1A1TP53TSHRFFAR1CPT2 | |
| SCHEMBL6569213 | 0.90 | ALDH1A1 (0.56) | ALDH1A1TP53TSHRFFAR1CPT2 | |
| SCHEMBL2180506 | 0.83 | — | — | |
| Hydrochloric Acid SCHEMBL6641911 | 0.81 | TSHR (0.46) | ALDH1A1TP53TSHR | |
| Ammonia Solution, Strong SCHEMBL27686666 | 0.81 | TSHR (0.46) | ALDH1A1TP53TSHR | |
| SCHEMBL11813593 | 0.80 | ALDH1A1 (0.48) | ALDH1A1TP53TSHR | |
| SCHEMBL11672965 | 0.78 | ALDH1A1 (0.46) | ALDH1A1TP53TSHR | |
| SCHEMBL15457453 | 0.78 | MAPT (0.37) | ALDH1A1FFAR1CPT2TDP1 | |
| SCHEMBL2632359 | 0.77 | ALDH1A1 (0.44) | ALDH1A1TP53TSHR |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4332740-A | REACTION OF POTASSIUM SALT OF HYDROPEROXIDE WITH ACYL HALIDE IN NONPOLAR SOLVENT | NIPPON OIL AND FATS CO., LTD. (JP) | 1982-06-01 | — | — | US | claimed |
| US-4332740-A | REACTION OF POTASSIUM SALT OF HYDROPEROXIDE WITH ACYL HALIDE IN NONPOLAR SOLVENT | NIPPON OIL AND FATS CO., LTD. (JP) | 1982-06-01 | — | — | US | disclosed |