Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.61 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.61 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.61 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.61 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.61 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.61 |
| ▸ | THPO | P40225 | 1/20 | 0.61 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.59 |
| ▸ | KCNQ2 | O43526 | 3/20 | 0.49 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
| ▸ | ATM | Q13315 | 1/20 | 0.44 |
| ▸ | PDE4A | P27815 | 3/20 | 0.38 |
| ▸ | PDE4B | Q07343 | 3/20 | 0.38 |
| ▸ | PDE4C | Q08493 | 3/20 | 0.38 |
| ▸ | PDE4D | Q08499 | 3/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | ESR1 | P03372 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 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 | |
|---|---|---|---|---|
| Water SCHEMBL9388270 | 0.99 | MAPK1 (0.61) | ALDH1A1CYP1A2CYP3A4CYP2C9CYP2D6 | |
| Water SCHEMBL9388278 | 0.99 | MAPK1 (0.61) | ALDH1A1CYP1A2CYP3A4CYP2C9CYP2D6 | |
| SCHEMBL8874045 | 0.84 | ALDH1A1 (0.62) | ALDH1A1CYP1A2CYP3A4CYP2C9CYP2D6 | |
| SCHEMBL8860073 | 0.81 | CYP1A2 (0.53) | ALDH1A1CYP1A2CYP3A4CYP2C9CYP2D6 | |
| SCHEMBL8295650 | 0.81 | ALDH1A1 (0.66) | ALDH1A1CYP1A2CYP3A4CYP2C9CYP2D6 | |
| Hydrochloric Acid SCHEMBL8300406 | 0.80 | MAPK1 (0.65) | ALDH1A1CYP1A2CYP3A4CYP2C9CYP2D6 | |
| SCHEMBL8860187 | 0.78 | ALDH1A1 (0.66) | ALDH1A1CYP1A2CYP3A4CYP2C9CYP2D6 | |
| Linopirdine SCHEMBL122699 | 0.76 | ALDH1A1 (1.00) | ALDH1A1CYP1A2CYP3A4CYP2C9CYP2D6 | |
| SCHEMBL8807631 | 0.75 | ALDH1A1 (0.97) | ALDH1A1CYP1A2CYP3A4CYP2C9CYP2D6 | |
| Linopirdine SCHEMBL360113 | 0.75 | MAPK1 (0.97) | ALDH1A1CYP1A2CYP3A4CYP2C9CYP2D6 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5597916-A | 1 substituted oxindoles and azaoxindoles | THE DUPONT MERCK PHARMACEUTICAL COMPANY (US) | 1997-01-28 | — | — | US | disclosed |
| US-5519132-A | ALZHEIMER*S DISEASE, NERVOUS SYSTEM DISORDERS, PROMOTE RELEASE OF ACETYLCHOLINE | THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) | 1996-05-21 | — | — | US | disclosed |
| US-5428035-A | Enhance the release of neurotransmitter acetylcholine and useful for treating alzheimer's disease and cognition activator | THE DUPONT MERCK PHARMACEUTICAL COMPANY (US) | 1995-06-27 | — | — | US | disclosed |
| WO-1994007891-A1 | 1-SUBSTITUTED OXINDOLES AND AZAOXINDOLES AS NOVEL COGNITION ENHANCERS | THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) | 1994-04-14 | — | — | WO | disclosed |
| US-5296478-A | 1-substituted oxindoles as cognition enhancers | THE DUPONT MERCK PHARMACEUTICAL CO. (US) | 1994-03-22 | — | — | US | disclosed |