Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 2/20 | 0.50 |
| ▸ | BCHE | P06276 | 4/20 | 0.46 |
| ▸ | ACHE | P22303 | 1/20 | 0.43 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.42 |
| ▸ | MTOR | P42345 | 1/20 | 0.42 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.40 |
| ▸ | KLK7 | P49862 | 3/20 | 0.38 |
| ▸ | KLK5 | Q9Y337 | 2/20 | 0.38 |
| ▸ | PSEN1 | P49768 | 2/20 | 0.38 |
| ▸ | PSEN2 | P49810 | 2/20 | 0.38 |
| ▸ | APH1B | Q8WW43 | 2/20 | 0.38 |
| ▸ | NCSTN | Q92542 | 2/20 | 0.38 |
| ▸ | APH1A | Q96BI3 | 2/20 | 0.38 |
| ▸ | PSENEN | Q9NZ42 | 2/20 | 0.38 |
| ▸ | CTSV | O60911 | 1/20 | 0.37 |
| ▸ | CTSL | P07711 | 1/20 | 0.37 |
| ▸ | CTSB | P07858 | 1/20 | 0.37 |
| ▸ | CTSS | P25774 | 1/20 | 0.37 |
| ▸ | CTSK | P43235 | 1/20 | 0.37 |
| ▸ | CTSC | P53634 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL23867773 | 1.00 | SLC6A2 (0.50) | SLC6A2BCHEACHEPDPK1MTOR | |
| SCHEMBL19430369 | 1.00 | SLC6A2 (0.50) | SLC6A2BCHEACHEPDPK1MTOR | |
| SCHEMBL22031145 | 0.89 | SLC6A2 (0.48) | SLC6A2BCHEACHEPDPK1MTOR | |
| SCHEMBL22030353 | 0.89 | SLC6A2 (0.48) | SLC6A2BCHEACHEPDPK1MTOR | |
| SCHEMBL7565013 | 0.89 | SLC6A2 (0.48) | SLC6A2BCHEACHEPDPK1MTOR | |
| SCHEMBL5804981 | 0.89 | SLC6A2 (0.48) | SLC6A2BCHEACHEPDPK1MTOR | |
| Bromide SCHEMBL7565722 | 0.88 | SLC6A2 (0.47) | SLC6A2BCHEACHEPDPK1MTOR | |
| SCHEMBL19742362 | 0.87 | SLC6A2 (0.52) | SLC6A2BCHEACHEPDPK1MTOR | |
| SCHEMBL8600114 | 0.86 | SLC6A2 (0.45) | SLC6A2BCHEACHEPDPK1MTOR | |
| SCHEMBL7145503 | 0.86 | SLC6A2 (0.45) | SLC6A2BCHEACHEPDPK1MTOR |
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 |
|---|---|---|---|---|---|---|---|
| EP-3357931-B1 | METHODS OF SYNTHESIS OF TRITERPENE PROSAPOGENINS AND TRITERPENE SAPONINS | SLOAN KETTERING INST CANCER RES (US) | 2020-07-22 | — | — | EP | disclosed |