Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 1/20 | 0.38 |
| ▸ | CA9 | Q16790 | 1/20 | 0.38 |
| ▸ | MAOB | P27338 | 2/20 | 0.36 |
| ▸ | PNMT | P11086 | 1/20 | 0.36 |
| ▸ | CD44 | P16070 | 1/20 | 0.36 |
| ▸ | OXTR | P30559 | 1/20 | 0.33 |
| ▸ | PRCP | P42785 | 1/20 | 0.32 |
| ▸ | RYR2 | Q92736 | 1/20 | 0.32 |
| ▸ | MAOA | P21397 | 1/20 | 0.31 |
| ▸ | HTR2C | P28335 | 1/20 | 0.31 |
| ▸ | METAP2 | P50579 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
| ▸ | PARP1 | P09874 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL1165406 | 0.81 | CA12 (0.52) | CA12CA9MAOBPNMTCD44 | |
| Hydrochloric Acid SCHEMBL32672905 | 0.79 | CA12 (0.50) | CA12CA9MAOBPNMTCD44 | |
| SCHEMBL24657 | 0.78 | MAOA (0.46) | MAOBPNMTMAOAHTR2CMETAP2 | |
| SCHEMBL476341 | 0.78 | CES1 (0.46) | MAOBMAOAPARP1 | |
| Water SCHEMBL28256098 | 0.71 | PNMT (0.62) | MAOBPNMTCD44OXTRPRCP | |
| SCHEMBL24206 | 0.69 | MAOA (0.46) | MAOBPNMTMAOAHTR2CMETAP2 | |
| SCHEMBL4312831 | 0.69 | CES1 (0.46) | MAOBMAOAPARP1 | |
| SCHEMBL71211 | 0.69 | — | — | |
| SCHEMBL134194 | 0.69 | — | — | |
| SCHEMBL6293496 | 0.69 | CA12 (0.38) | CA12CA9MAOBPNMTCD44 |
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 |
|---|---|---|---|---|---|---|---|
| US-5686466-A | CHOLINESERASE INHIBITOR; TREATMENT OF SENILE DEMENTIA, ALZHEIMER'S DISEASE | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1997-11-11 | — | — | US | claimed |
| EP-0607864-A2 | Tricyclic condensed heterocyclic compounds for the treatment of senile dementic | Takeda Chemical Industries, Ltd. (JP) | 1994-07-27 | — | — | EP | claimed |