Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.53 |
| ▸ | TSHR | P16473 | 2/20 | 0.53 |
| ▸ | MEN1 | O00255 | 2/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.50 |
| ▸ | AR | P10275 | 1/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | ELANE | P08246 | 3/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.48 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.46 |
| ▸ | PKM | P14618 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.46 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | USP2 | O75604 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.45 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL5922655 | 0.85 | GAA (0.57) | ALDH1A1TSHRMEN1KMT2AAR | |
| SCHEMBL10903942 | 0.85 | NPSR1 (0.42) | ALDH1A1TSHRMAPTHSD17B10PKM | |
| SCHEMBL3180552 | 0.82 | TSHR (0.45) | ALDH1A1TSHRMAPTHSD17B10PKM | |
| SCHEMBL10899845 | 0.79 | MGLL (0.54) | ALDH1A1TSHRMEN1KMT2AMAPT | |
| SCHEMBL13483836 | 0.79 | ALDH1A1 (0.56) | ALDH1A1TSHRMEN1KMT2AAR | |
| SCHEMBL13484195 | 0.77 | ALDH1A1 (0.59) | ALDH1A1TSHRMEN1KMT2AAR | |
| SCHEMBL10904126 | 0.76 | TSHR (0.60) | ALDH1A1TSHRMEN1KMT2AMAPT | |
| SCHEMBL13480910 | 0.76 | AR (0.52) | ALDH1A1TSHRMEN1KMT2AAR | |
| SCHEMBL3181970 | 0.76 | AR (0.52) | ALDH1A1TSHRMEN1KMT2AAR | |
| SCHEMBL5238405 | 0.76 | AR (0.52) | ALDH1A1TSHRMEN1KMT2AAR |
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-4596826-A | Anticonvulsants | EISAI CO., LTD. (JP) | 1986-06-24 | — | — | US | disclosed |