Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | PPARG | P37231 | 1/20 | 0.39 |
| ▸ | ESR1 | P03372 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.38 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.38 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.38 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.38 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.38 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.38 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.38 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.38 |
| ▸ | HDAC6 | Q9UBN7 | 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 | |
|---|---|---|---|---|
| SCHEMBL8458300 | 0.87 | KDM4E (0.41) | ALDH1A1HPGDESR1CYP3A4ESR2 | |
| SCHEMBL8458667 | 0.78 | KMT2A (0.51) | ALDH1A1MAPTHDAC3HDAC4HDAC1 | |
| SCHEMBL3280418 | 0.74 | POLB (0.55) | ALDH1A1HPGDPOLBCYP3A4MAPT | |
| SCHEMBL11262719 | 0.72 | POLB (0.53) | ALDH1A1HPGDPOLBCYP3A4MAPT | |
| SCHEMBL9482262 | 0.72 | CHEK1 (0.37) | ALDH1A1HPGDESR1CYP3A4ESR2 | |
| SCHEMBL8458616 | 0.71 | ALDH1A1 (0.40) | ALDH1A1ESR1CYP3A4ESR2CYP2C19 | |
| SCHEMBL3943718 | 0.71 | CYP2C19 (0.44) | ALDH1A1HPGDPOLBMAPTCYP2C19 | |
| SCHEMBL9214864 | 0.71 | NR4A2 (0.40) | ALDH1A1HPGDNR4A2POLBPPARG | |
| SCHEMBL11193576 | 0.70 | ALDH1A1 (0.37) | ALDH1A1HPGDPOLBESR1CYP3A4 | |
| Benzoic Acid SCHEMBL10782385 | 0.69 | TSHR (0.54) | ALDH1A1NR4A2POLBESR1CYP3A4 |
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-5962521-A | PROSTATE GLANDS DISORDERS | GUILFORD PHARMACEUTICALS INC. (US) | 1999-10-05 | — | — | US | disclosed |