Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.40 |
| ▸ | XDH | P47989 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.40 |
| ▸ | PPARG | P37231 | 2/20 | 0.39 |
| ▸ | PPARD | Q03181 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | ALDH2 | P05091 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.39 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | CNR1 | P21554 | 1/20 | 0.39 |
| ▸ | CNR2 | P34972 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL2375512 | 0.81 | HCAR2 (0.55) | ALDH1A1SMN1; SMN2CYP3A4TSHRKDM4E | |
| Hydrogen Peroxide SCHEMBL7816450 | 0.77 | ALDH1A1 (0.58) | ALDH1A1SMN1; SMN2CYP3A4XDHTP53 | |
| Hydrogen Peroxide SCHEMBL5496256 | 0.77 | ALDH1A1 (0.58) | ALDH1A1SMN1; SMN2CYP3A4XDHTP53 | |
| SCHEMBL5696000 | 0.76 | GLA (0.53) | ALDH1A1SMN1; SMN2CYP3A4XDHTP53 | |
| SCHEMBL10621532 | 0.76 | MAOB (0.46) | ALDH1A1SMN1; SMN2CYP3A4XDHTP53 | |
| SCHEMBL6547403 | 0.76 | CYP4F2 (0.45) | TSHRAKR1B1HDAC8MAOBTBXAS1 | |
| SCHEMBL6547408 | 0.76 | CYP4F2 (0.45) | TSHRAKR1B1HDAC8MAOBTBXAS1 | |
| SCHEMBL6548882 | 0.74 | CA12 (0.38) | CYP3A4MEN1MAPTAKR1B1KMT2A | |
| SCHEMBL6548879 | 0.74 | CA12 (0.38) | CYP3A4MEN1MAPTAKR1B1KMT2A | |
| SCHEMBL1363530 | 0.74 | MAOB (0.47) | ALDH1A1SMN1; SMN2CYP3A4TP53ALOX15 |
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-4598083-A | INSECTICIDES, NEMATOCIDES | SCHERING AKTIENGESELLSCHAFT (DE) | 1986-07-01 | — | — | US | disclosed |