Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | PARP1 | P09874 | 1/20 | 0.39 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.39 |
| ▸ | KDM1A | O60341 | 1/20 | 0.38 |
| ▸ | METAP1 | P53582 | 1/20 | 0.37 |
| ▸ | BACE1 | P56817 | 3/20 | 0.35 |
| ▸ | APP | P05067 | 1/20 | 0.35 |
| ▸ | TDP2 | O95551 | 1/20 | 0.33 |
| ▸ | TGM2 | P21980 | 1/20 | 0.32 |
| ▸ | CES1 | P23141 | 1/20 | 0.32 |
| ▸ | PNMT | P11086 | 1/20 | 0.32 |
| ▸ | ASIC3 | Q9UHC3 | 1/20 | 0.32 |
| ▸ | TYMS | P04818 | 2/20 | 0.31 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.31 |
| ▸ | ROS1 | P08922 | 1/20 | 0.31 |
| ▸ | MARK3 | P27448 | 1/20 | 0.31 |
| ▸ | LTK | P29376 | 1/20 | 0.31 |
| ▸ | FLT4 | P35916 | 1/20 | 0.31 |
| ▸ | KDR | P35968 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL8779123 | 0.80 | TDP2 (0.36) | TDP2TGM2CES1PNMTTYMS | |
| SCHEMBL8779101 | 0.80 | TDP1 (0.50) | TDP1L3MBTL1PARP1PARP10KDM1A | |
| SCHEMBL8779088 | 0.80 | PARP1 (0.39) | PARP1PARP10KDM1ATYMSSIGMAR1 | |
| SCHEMBL8779056 | 0.80 | F7 (0.39) | PARP1PARP10KDM1AMETAP1SIGMAR1 | |
| SCHEMBL8779005 | 0.80 | MAPT (0.33) | TDP1L3MBTL1TYMS | |
| SCHEMBL17355136 | 0.80 | TDP1 (0.43) | TDP1L3MBTL1KDM1AMETAP1BACE1 | |
| SCHEMBL449033 | 0.78 | TDP1 (0.44) | TDP1L3MBTL1PARP1PARP10KDM1A | |
| SCHEMBL8778942 | 0.76 | METAP1 (0.44) | KDM1AMETAP1SIGMAR1 | |
| SCHEMBL7889527 | 0.76 | METAP1 (0.41) | TDP1L3MBTL1PARP1PARP10KDM1A | |
| SCHEMBL8778991 | 0.75 | SIGMAR1 (0.44) | TDP1L3MBTL1CES1SIGMAR1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0606661-B1 | Octahydrophenanthrene derivatives and their use as NMDA-Antagonists | HOFFMANN LA ROCHE (CH) | 1997-03-12 | — | — | EP | disclosed |
| US-5385947-A | For prevention of nerve damage due to reduction of blood or oxygen supplies | HOFFMANN-LA ROCHE INC. (US) | 1995-01-31 | — | — | US | disclosed |
| EP-0606661-A1 | Octahydrophenanthrene derivatives and their use as NMDA-Antagonists | F. HOFFMANN-LA ROCHE AG (CH) | 1994-07-20 | — | — | EP | disclosed |