Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.32 |
| ▸ | TSHR | P16473 | 3/20 | 0.32 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.31 |
| ▸ | TET2 | Q6N021 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL15973850 | 0.78 | CYP2C19 (0.35) | CYP2C19 | |
| SCHEMBL17419430 | 0.78 | CYP2C19 (0.35) | CYP2C19 | |
| SCHEMBL11498755 | 0.76 | ALDH1A1 (0.37) | ALDH1A1TSHRTRPA1CYP3A4HPGD | |
| SCHEMBL27569759 | 0.75 | — | — | |
| Propionic Acid SCHEMBL11771893 | 0.75 | FFAR3 (0.39) | ALDH1A1TSHRTRPA1CYP3A4HPGD | |
| SCHEMBL7591079 | 0.74 | ALDH1A1 (0.33) | ALDH1A1TSHRTRPA1CYP3A4HPGD | |
| SCHEMBL4290498 | 0.74 | PKM (0.38) | ALDH1A1TSHRCYP3A4ALOX15SMN1; SMN2 | |
| SCHEMBL2362804 | 0.72 | ALDH1A1 (0.39) | ALDH1A1 | |
| SCHEMBL10967037 | 0.70 | — | — | |
| Bicarbonate SCHEMBL28903846 | 0.70 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-5690904-A | BRAIN IMAGING AGENTS | AMERSHAM INTERNATIONAL PLC (GB) | 1997-11-25 | — | — | US | disclosed |