Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.50 |
| ▸ | HPGD | P15428 | 4/20 | 0.50 |
| ▸ | TSHR | P16473 | 2/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.50 |
| ▸ | MAPT | P10636 | 2/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | METAP2 | P50579 | 1/20 | 0.47 |
| ▸ | BCAT2 | O15382 | 1/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | PARP1 | P09874 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.41 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.40 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| Allyl Alcohol SCHEMBL29155882 | 0.87 | KDM4E (0.54) | KDM4EALDH1A1HPGDTSHRHSD17B10 | |
| Phthalic Acid SCHEMBL29144166 | 0.83 | ALDH1A1 (0.61) | KDM4EALDH1A1HPGDTSHRHSD17B10 | |
| Phthalic Acid SCHEMBL28549489 | 0.83 | ALDH1A1 (0.61) | KDM4EALDH1A1HPGDTSHRHSD17B10 | |
| Ethylene SCHEMBL20567426 | 0.81 | ALDH1A1 (0.64) | KDM4EALDH1A1HPGDTSHRHSD17B10 | |
| Benzamide SCHEMBL11771049 | 0.81 | CYP3A4 (0.67) | KDM4EALDH1A1HPGDTSHRHSD17B10 | |
| SCHEMBL39118 | 0.81 | ALDH1A1 (0.70) | KDM4EALDH1A1HPGDTSHRHSD17B10 | |
| SCHEMBL27700719 | 0.81 | ALDH1A1 (0.70) | KDM4EALDH1A1HPGDTSHRHSD17B10 | |
| SCHEMBL4967588 | 0.81 | ALDH1A1 (0.70) | KDM4EALDH1A1HPGDTSHRHSD17B10 | |
| SCHEMBL5578215 | 0.80 | KDM4E (0.49) | KDM4EALDH1A1HPGDTSHRHSD17B10 | |
| Acrylic Acid SCHEMBL29610346 | 0.80 | KDM4E (0.52) | KDM4EALDH1A1HPGDTSHRHSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| CN-105777614-A | Cyclamine alkylamide ferulate compound as well as preparation method and application thereof | 南阳师范学院 | 2016-07-20 | — | — | CN | disclosed |