Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 4/20 | 0.39 |
| ▸ | ESR2 | Q92731 | 4/20 | 0.39 |
| ▸ | PARP1 | P09874 | 11/20 | 0.38 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.34 |
| ▸ | ACHE | P22303 | 2/20 | 0.34 |
| ▸ | HTR2C | P28335 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL6623975 | 0.88 | PARP1 (0.39) | PARP1ACHEHTR2C | |
| SCHEMBL6622880 | 0.88 | PARP1 (0.48) | ESR1ESR2PARP1HTR2C | |
| SCHEMBL6623507 | 0.87 | MAPT (0.39) | PARP1PTGS2ACHEHTR2C | |
| SCHEMBL6625155 | 0.87 | KDM4E (0.39) | PARP1PTGS2ACHEHTR2C | |
| SCHEMBL6624238 | 0.87 | KDM4E (0.39) | PARP1PTGS2HTR2C | |
| Hydrochloric Acid SCHEMBL6626987 | 0.86 | PARP1 (0.47) | PARP1HTR2C | |
| SCHEMBL8221147 | 0.84 | PARP1 (0.54) | PARP1 | |
| SCHEMBL6623262 | 0.84 | PARP1 (0.54) | PARP1PTGS2HTR2C | |
| SCHEMBL6628137 | 0.81 | SMN1; SMN2 (0.40) | PARP1ACHE | |
| SCHEMBL6623691 | 0.81 | PARP1 (0.54) | PARP1 |
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-0858996-B1 | NERVE CELL PROTECTIVE AGENTS | MOCHIDA PHARM CO LTD (JP) | 2004-10-27 | — | — | EP | disclosed |
| US-6040331-A | Nerve cell protective agents | MOCHIDA PHARMACEUTICAL CO., LTD. (JP) | 2000-03-21 | — | — | US | disclosed |
| EP-0858996-A1 | NERVE CELL PROTECTIVE AGENTS | MOCHIDA PHARMACEUTICAL CO., LTD. (JP) | 1998-08-19 | — | — | EP | disclosed |