Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.44 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.44 |
| ▸ | CASP1 | P29466 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | CALM1 | P0DP23 | 1/20 | 0.38 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.37 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 4/20 | 0.36 |
| ▸ | IDO1 | P14902 | 1/20 | 0.35 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.35 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.33 |
| ▸ | MAOA | P21397 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL1107767 | 0.85 | TP53 (0.48) | ALDH1A1HPGDALOX15ALOX12CASP1 | |
| SCHEMBL11363391 | 0.79 | ALDH1A1 (0.43) | ALDH1A1HPGDALOX15ALOX12CASP1 | |
| SCHEMBL14838179 | 0.78 | TP53 (0.48) | ALDH1A1TP53CALM1NR1H2NR1H3 | |
| SCHEMBL1271761 | 0.78 | TP53 (0.42) | ALDH1A1TP53CALM1NR1H2NR1H3 | |
| SCHEMBL8970493 | 0.76 | TSHR (0.46) | ALDH1A1TP53CALM1NR1H2NR1H3 | |
| SCHEMBL5514135 | 0.76 | TSHR (0.46) | ALDH1A1HPGDTP53CALM1NR1H2 | |
| SCHEMBL9075995 | 0.76 | LOXL2 (0.46) | ALDH1A1TP53CALM1NR1H2NR1H3 | |
| SCHEMBL9076841 | 0.76 | TP53 (0.40) | ALDH1A1TP53CALM1NR1H2NR1H3 | |
| Hydrochloric Acid SCHEMBL9074421 | 0.74 | LOXL2 (0.44) | TP53CALM1NR1H2NR1H3LOXL2 | |
| SCHEMBL28103762 | 0.74 | TP53 (0.44) | ALDH1A1TP53CALM1NR1H2NR1H3 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5536732-A | REDUCING INFECTIOUSNESS OF HIV | MERRELL PHARMACEUTICALS INC. (US) | 1996-07-16 | — | — | US | disclosed |
| EP-0454580-B1 | Novel nojirimycin derivatives | MERRELL DOW PHARMA (US) | 1995-12-27 | — | — | EP | disclosed |
| US-5252587-A | Viricides, aids therapy, antidiabetic agent | MERRELL DOW PHARMACEUTICALS, INC. (US) | 1993-10-12 | — | — | US | disclosed |
| EP-0454580-A2 | Novel nojirimycin derivatives | MERRELL DOW PHARMACEUTICALS INC. (US) | 1991-10-30 | — | — | EP | disclosed |
| EP-0453692-A1 | Novel nojirimycin derivatives | MERRELL DOW PHARMACEUTICALS INC. (US) | 1991-10-30 | — | — | EP | disclosed |
| US-4434161-A | ANTICHOLESTEROL | SANDOZ, INC. (US) | 1984-02-28 | — | — | US | disclosed |