Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C2 | P52895 | 8/20 | 0.53 |
| ▸ | AKR1C1 | Q04828 | 8/20 | 0.53 |
| ▸ | AKR1C4 | P17516 | 2/20 | 0.53 |
| ▸ | AKR1C3 | P42330 | 2/20 | 0.53 |
| ▸ | HPGD | P15428 | 4/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.52 |
| ▸ | MEN1 | O00255 | 1/20 | 0.52 |
| ▸ | MAPT | P10636 | 1/20 | 0.52 |
| ▸ | PKM | P14618 | 1/20 | 0.52 |
| ▸ | HTT | P42858 | 1/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.52 |
| ▸ | TSHR | P16473 | 4/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.48 |
| ▸ | TTR | P02766 | 1/20 | 0.43 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.42 |
| ▸ | CSNK2A2 | P19784 | 1/20 | 0.41 |
| ▸ | CSNK2B | P67870 | 1/20 | 0.41 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL2891876 | 0.96 | AKR1C2 (0.57) | AKR1C2AKR1C1AKR1C4AKR1C3HPGD | |
| SCHEMBL30632048 | 0.96 | AKR1C2 (0.57) | AKR1C2AKR1C1AKR1C4AKR1C3HPGD | |
| SCHEMBL1513825 | 0.83 | AKR1C2 (0.63) | AKR1C2AKR1C1AKR1C4AKR1C3HPGD | |
| SCHEMBL11763697 | 0.78 | HSD17B10 (0.52) | AKR1C2AKR1C1AKR1C4AKR1C3HPGD | |
| SCHEMBL14273026 | 0.78 | AKR1C2 (0.57) | AKR1C2AKR1C1AKR1C4AKR1C3HPGD | |
| SCHEMBL1437003 | 0.78 | CYP3A4 (0.48) | AKR1C2AKR1C1AKR1C4AKR1C3HPGD | |
| SCHEMBL2149302 | 0.78 | AKR1C2 (0.52) | AKR1C2AKR1C1AKR1C4AKR1C3HPGD | |
| SCHEMBL7005963 | 0.78 | AKR1C2 (0.52) | AKR1C2AKR1C1AKR1C4AKR1C3HPGD | |
| SCHEMBL28883530 | 0.78 | AKR1C2 (0.52) | AKR1C2AKR1C1AKR1C4AKR1C3HPGD | |
| Fluoride SCHEMBL6445648 | 0.76 | CYP3A4 (0.47) | AKR1C2AKR1C1AKR1C4AKR1C3HPGD |
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-115737481-A | Sweat-inhibiting, sterilizing and deodorizing composition | 深圳市理然化妆品有限公司 | 2023-03-07 | — | — | CN | claimed |
| CN-115737481-A | Sweat-inhibiting, sterilizing and deodorizing composition | 深圳市理然化妆品有限公司 | 2023-03-07 | — | — | CN | disclosed |