Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.61 |
| ▸ | POLB | P06746 | 1/20 | 0.61 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.58 |
| ▸ | HTT | P42858 | 2/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.54 |
| ▸ | HPGD | P15428 | 5/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.50 |
| ▸ | ESR1 | P03372 | 1/20 | 0.50 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.50 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.50 |
| ▸ | HMGB1 | P09429 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | GGT1 | P19440 | 1/20 | 0.50 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.50 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.50 |
| ▸ | BLM | P54132 | 1/20 | 0.50 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.50 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.50 |
| ▸ | USP2 | O75604 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL28560551 | 0.98 | KDM4E (0.63) | KDM4EPOLBCTNNB1HTTALDH1A1 | |
| SCHEMBL30775026 | 0.90 | KDM4E (0.77) | KDM4EPOLBCTNNB1HTTALDH1A1 | |
| SCHEMBL2854892 | 0.90 | KDM4E (0.77) | KDM4EPOLBCTNNB1HTTALDH1A1 | |
| SCHEMBL1798 | 0.88 | CTNNB1 (0.71) | KDM4ECTNNB1HTTALDH1A1HPGD | |
| SCHEMBL742799 | 0.88 | CTNNB1 (0.53) | KDM4EPOLBCTNNB1HTTALDH1A1 | |
| SCHEMBL30975119 | 0.88 | CTNNB1 (0.53) | KDM4EPOLBCTNNB1HTTALDH1A1 | |
| SCHEMBL921873 | 0.88 | AKR1C3 (0.69) | KDM4EPOLBCTNNB1HTTALDH1A1 | |
| SCHEMBL2657444 | 0.87 | KDM4E (0.56) | KDM4EPOLBCTNNB1HTTALDH1A1 | |
| SCHEMBL11407865 | 0.86 | CTNNB1 (0.69) | KDM4ECTNNB1HTTALDH1A1HPGD | |
| Bicarbonate SCHEMBL21517637 | 0.86 | CTNNB1 (0.69) | KDM4ECTNNB1HTTALDH1A1HPGD |
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-109021018-A | A kind of multicore manganese complex and preparation method thereof and the adjustment effect that kaffir lily seed is sprouted | 陕西理工大学 | 2018-12-18 | — | — | CN | disclosed |