Known targets — ChEMBL curated mechanism
CACNA1CCACNA1DCACNA1FCACNA1SDPP4HTR1BHTR1D
The experimentally established mechanism targets of Borneol. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 1/20 | 0.46 |
| ▸ | CA4 | P22748 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 3/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.42 |
| ▸ | EPHX2 | P34913 | 3/20 | 0.41 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.37 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.36 |
| ▸ | CXCR3 | P49682 | 1/20 | 0.36 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.36 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.36 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.36 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.36 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.36 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| Dexborneol SCHEMBL28250994 | 1.00 | CA2 (0.46) | CA2CA4KMT2AMEN1CYP2C19 | |
| Borneol SCHEMBL29022976 | 0.87 | KMT2A (0.47) | KMT2AMEN1CYP2C19HTTSMN1; SMN2 | |
| Dexborneol SCHEMBL29022977 | 0.87 | KMT2A (0.47) | KMT2AMEN1CYP2C19HTTSMN1; SMN2 | |
| Dexborneol SCHEMBL28706552 | 0.83 | KMT2A (0.50) | KMT2AMEN1CYP2C19HTTSMN1; SMN2 | |
| Terephthalic Acid SCHEMBL31540151 | 0.81 | KMT2A (0.50) | KMT2AMEN1CYP2C19HTTSMN1; SMN2 | |
| Terephthalic Acid SCHEMBL31454019 | 0.81 | KMT2A (0.50) | KMT2AMEN1CYP2C19HTTSMN1; SMN2 | |
| Dexborneol SCHEMBL28561708 | 0.81 | KMT2A (0.41) | KMT2AMEN1CYP2C19HTTSMN1; SMN2 | |
| Dexborneol SCHEMBL28299334 | 0.80 | KMT2A (0.44) | KMT2AMEN1CYP2C19HTTSMN1; SMN2 | |
| Phthalic Acid SCHEMBL27666788 | 0.80 | KMT2A (0.45) | KMT2AMEN1CYP2C19HTTSMN1; SMN2 | |
| Dexborneol SCHEMBL28702109 | 0.78 | SIGMAR1 (0.50) | KMT2AMEN1CYP2C19HTTSMN1; 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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-104306841-B | A kind of Chinese medicinal lotion for treating gynaecological imflammation, scytitis, pruritus | 湖南守护神制药有限公司 | 2018-10-09 | — | — | CN | disclosed |