Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.55 |
| ▸ | HPGD | P15428 | 1/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.55 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.46 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.46 |
| ▸ | MLYCD | O95822 | 5/20 | 0.43 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.41 |
| ▸ | ERN1 | O75460 | 2/20 | 0.41 |
| ▸ | KIF11 | P52732 | 1/20 | 0.41 |
| ▸ | PDK2 | Q15119 | 2/20 | 0.40 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.40 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.40 |
| ▸ | PGR | P06401 | 1/20 | 0.39 |
| ▸ | AR | P10275 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.38 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.38 |
| ▸ | MMP2 | P08253 | 1/20 | 0.38 |
| ▸ | MMP9 | P14780 | 1/20 | 0.38 |
| ▸ | MMP8 | P22894 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL9177317 | 0.87 | MLYCD (0.47) | ALDH1A1HPGDSMN1; SMN2EPHX2NR1H4 | |
| SCHEMBL9183737 | 0.84 | MLYCD (0.44) | ALDH1A1HPGDSMN1; SMN2EPHX2NR1H4 | |
| SCHEMBL1004649 | 0.83 | ALDH1A1 (0.73) | ALDH1A1HPGDSMN1; SMN2EPHX2NR1H4 | |
| SCHEMBL10031827 | 0.83 | PGR (0.47) | ALDH1A1SMN1; SMN2MLYCDPGRAR | |
| SCHEMBL4403418 | 0.78 | NR1H4 (0.68) | ALDH1A1HPGDSMN1; SMN2EPHX2NR1H4 | |
| SCHEMBL855138 | 0.78 | ALDH1A1 (0.61) | ALDH1A1HPGDSMN1; SMN2MAPT | |
| SCHEMBL9183456 | 0.78 | MLYCD (0.40) | ALDH1A1HPGDSMN1; SMN2MLYCDPGR | |
| SCHEMBL9184548 | 0.77 | KMT2A (0.60) | ALDH1A1HPGDNR1H4MLYCDHDAC4 | |
| SCHEMBL13840760 | 0.77 | ALDH1A1 (0.43) | ALDH1A1HPGDNR1H4MLYCDPGR | |
| SCHEMBL22359622 | 0.77 | ALDH1A1 (0.59) | ALDH1A1HPGDSMN1; SMN2EPHX2NR1H4 |
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-5378728-A | Benzoic acid derivatives as antidiabetic agents | SANDOZ LTD. (CH) | 1995-01-03 | — | — | US | claimed |
| US-5378728-A | Benzoic acid derivatives as antidiabetic agents | SANDOZ LTD. (CH) | 1995-01-03 | — | — | US | disclosed |