Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 2/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.50 |
| ▸ | GAA | P10253 | 1/20 | 0.50 |
| ▸ | CTSS | P25774 | 2/20 | 0.49 |
| ▸ | CTSK | P43235 | 2/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | CA2 | P00918 | 1/20 | 0.47 |
| ▸ | CACNA1B | Q00975 | 3/20 | 0.46 |
| ▸ | TRPA1 | O75762 | 2/20 | 0.46 |
| ▸ | KLK5 | Q9Y337 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | SYK | P43405 | 1/20 | 0.43 |
| ▸ | PPARA | Q07869 | 1/20 | 0.43 |
| ▸ | CA12 | O43570 | 1/20 | 0.43 |
| ▸ | CA7 | P43166 | 1/20 | 0.43 |
| ▸ | CA9 | Q16790 | 1/20 | 0.43 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.43 |
| ▸ | IL1RN | P18510 | 1/20 | 0.42 |
| ▸ | ERAP2 | Q6P179 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL19602353 | 1.00 | MEN1 (0.50) | MEN1KMT2AGAACTSSCTSK | |
| SCHEMBL19602659 | 0.91 | CTSS (0.48) | MEN1KMT2AGAACTSSCTSK | |
| SCHEMBL19602658 | 0.89 | CTSS (0.47) | MEN1KMT2AGAACTSSCTSK | |
| SCHEMBL28579344 | 0.87 | CACNA1B (0.56) | CTSSCTSKSMN1; SMN2CA2CACNA1B | |
| SCHEMBL28579345 | 0.87 | CACNA1B (0.56) | CTSSCTSKSMN1; SMN2CA2CACNA1B | |
| SCHEMBL6388701 | 0.87 | KLK5 (0.57) | MEN1KMT2ACTSSCTSKKLK5 | |
| SCHEMBL12873000 | 0.87 | KLK5 (0.57) | MEN1KMT2ACTSSCTSKKLK5 | |
| SCHEMBL12214464 | 0.87 | KLK5 (0.57) | MEN1KMT2ACTSSCTSKKLK5 | |
| SCHEMBL16554209 | 0.87 | CTSS (0.51) | MEN1KMT2ACTSSCTSKSMN1; SMN2 | |
| SCHEMBL16566319 | 0.87 | CTSS (0.51) | MEN1KMT2ACTSSCTSKSMN1; 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-109503637-A | For treating the noval chemical compound of the disease of helminth | 安纳考尔医药公司 | 2019-03-22 | — | — | CN | disclosed |
| CN-109153688-A | Oxaborolidine esters and uses thereof | 安纳考尔医药公司 | 2019-01-04 | — | — | CN | disclosed |