Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.50 |
| ▸ | HPGD | P15428 | 3/20 | 0.50 |
| ▸ | POLB | P06746 | 3/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.47 |
| ▸ | TYR | P14679 | 1/20 | 0.47 |
| ▸ | DAO | P14920 | 1/20 | 0.47 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | MAOB | P27338 | 4/20 | 0.46 |
| ▸ | CA12 | O43570 | 3/20 | 0.46 |
| ▸ | CA9 | Q16790 | 3/20 | 0.46 |
| ▸ | NT5E | P21589 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
| ▸ | ATM | Q13315 | 1/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL29926079 | 0.84 | KDM4E (0.48) | KDM4EALDH1A1HPGDPOLBSMN1; SMN2 | |
| SCHEMBL4633748 | 0.82 | HPGD (0.51) | KDM4EALDH1A1HPGDPOLBSMN1; SMN2 | |
| SCHEMBL106241 | 0.78 | MEN1 (0.60) | KDM4EALDH1A1HPGDPOLBSMN1; SMN2 | |
| SCHEMBL28437671 | 0.78 | HPGD (0.58) | KDM4EALDH1A1HPGDPOLBSMN1; SMN2 | |
| SCHEMBL8881621 | 0.77 | MEN1 (0.58) | KDM4EALDH1A1HPGDPOLBSMN1; SMN2 | |
| SCHEMBL30603420 | 0.77 | HPGD (0.53) | KDM4EALDH1A1HPGDPOLBSMN1; SMN2 | |
| SCHEMBL8881622 | 0.77 | MEN1 (0.58) | KDM4EALDH1A1HPGDPOLBSMN1; SMN2 | |
| SCHEMBL15842326 | 0.77 | HPGD (0.53) | KDM4EALDH1A1HPGDPOLBSMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL11233384 | 0.77 | MEN1 (0.58) | KDM4EALDH1A1HPGDPOLBSMN1; SMN2 | |
| SCHEMBL7806916 | 0.75 | HPGD (0.55) | KDM4EALDH1A1HPGDPOLBSMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-115057850-B | Aloe-emodin derivative and preparation method and application thereof | 中国医学科学院药用植物研究所 | 2023-11-10 | — | — | CN | disclosed |
| CN-115057850-A | Aloe-emodin derivative and preparation method and application thereof | 中国医学科学院药用植物研究所 | 2022-09-16 | — | — | CN | disclosed |