Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | COMT | P21964 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.41 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | APOBEC3G | Q9HC16 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | NSD2 | O96028 | 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL28306815 | 0.98 | COMT (0.42) | COMTKDM4EMAPTALDH1A1TDP1 | |
| SCHEMBL20113072 | 0.83 | KDM4E (0.42) | COMTKDM4EMAPTALDH1A1TDP1 | |
| SCHEMBL3448835 | 0.81 | CA2 (0.51) | COMTKDM4EMAPTALDH1A1TDP1 | |
| Hydrochloric Acid SCHEMBL28293570 | 0.80 | ALDH1A1 (0.44) | COMTKDM4EMAPTALDH1A1TDP1 | |
| SCHEMBL22188022 | 0.80 | KDM4E (0.41) | COMTKDM4EMAPTALDH1A1TDP1 | |
| SCHEMBL28268032 | 0.77 | KDM4E (0.42) | COMTKDM4EALDH1A1TDP1CYP1A2 | |
| SCHEMBL8518206 | 0.77 | ALDH1A1 (0.44) | COMTKDM4EMAPTALDH1A1CYP1A2 | |
| SCHEMBL9002773 | 0.76 | COMT (0.49) | COMTKDM4EMAPTALDH1A1TDP1 | |
| SCHEMBL27545462 | 0.75 | PIK3C3 (0.37) | COMTKDM4EMAPTALDH1A1CYP1A2 | |
| SCHEMBL4660499 | 0.74 | COMT (0.50) | COMTKDM4EMAPTALDH1A1TDP1 |
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-113651798-A | Preparation method of Voranolan fumarate | 广州白云山天心制药科技有限公司 | 2021-11-16 | — | — | CN | claimed |
| CN-115124506-A | Preparation method of medicine for digestive system | 广州白云山天心制药股份有限公司 | 2022-09-30 | — | — | CN | disclosed |