Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 6/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.48 |
| ▸ | MAPT | P10636 | 4/20 | 0.48 |
| ▸ | RAB9A | P51151 | 4/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.48 |
| ▸ | TNKS | O95271 | 4/20 | 0.48 |
| ▸ | NPC1 | O15118 | 4/20 | 0.48 |
| ▸ | MAOB | P27338 | 4/20 | 0.48 |
| ▸ | TP53 | P04637 | 3/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.48 |
| ▸ | LMNA | P02545 | 3/20 | 0.48 |
| ▸ | GLA | P06280 | 2/20 | 0.48 |
| ▸ | THRB | P10828 | 2/20 | 0.48 |
| ▸ | KCNA5 | P22460 | 1/20 | 0.48 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.48 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 3/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL2981579 | 0.82 | NPC1 (0.58) | HPGDCYP3A4SMN1; SMN2KDM4EMAPT | |
| SCHEMBL31140205 | 0.80 | MAOB (0.53) | HPGDCYP3A4SMN1; SMN2KDM4EMAPT | |
| SCHEMBL29799485 | 0.79 | MAOB (0.52) | HPGDCYP3A4KDM4EMAPTRAB9A | |
| SCHEMBL28167314 | 0.78 | AGXT (0.43) | HPGDSMN1; SMN2KDM4EMAPTRAB9A | |
| SCHEMBL9533970 | 0.78 | PPARG (0.55) | HPGDCYP3A4SMN1; SMN2KDM4ERAB9A | |
| SCHEMBL10520741 | 0.78 | ABCB1 (0.47) | HPGDCYP3A4SMN1; SMN2KDM4EMAPT | |
| SCHEMBL17237794 | 0.78 | MAOB (0.51) | HPGDCYP3A4KDM4EMAPTMAOB | |
| SCHEMBL26661266 | 0.78 | MAOB (0.51) | HPGDCYP3A4KDM4EMAPTMAOB | |
| SCHEMBL26661262 | 0.78 | MAOB (0.51) | HPGDCYP3A4KDM4EMAPTMAOB | |
| SCHEMBL28739774 | 0.77 | CYP3A4 (0.50) | HPGDCYP3A4SMN1; SMN2KDM4EMAPT |
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-110294732-B | Pharmaceutical compound for treating liver diseases and application thereof | 江苏新元素医药科技有限公司 | 2021-10-26 | — | — | CN | disclosed |