Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B1 | P15538 | 3/20 | 0.40 |
| ▸ | CYP11B2 | P19099 | 3/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.38 |
| ▸ | KCNQ2 | O43526 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.37 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 2/20 | 0.34 |
| ▸ | ATM | Q13315 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | LTA4H | P09960 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.33 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL28170701 | 0.88 | CALM1 (0.39) | CYP1A2CYP2C9POLBATMALDH1A1 | |
| SCHEMBL9208904 | 0.79 | CYP3A4 (0.34) | CYP11B1CYP11B2CYP1A2CYP3A4CYP2C9 | |
| Hydrochloric Acid SCHEMBL9218848 | 0.78 | CYP3A4 (0.33) | CYP11B1CYP11B2CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL28576366 | 0.73 | MAPT (0.41) | POLBATMALDH1A1MAPTMEN1 | |
| SCHEMBL9159521 | 0.73 | MAPT (0.37) | POLBATMALDH1A1MAPTMEN1 | |
| SCHEMBL6660995 | 0.73 | MAPT (0.37) | POLBATMALDH1A1MAPTMEN1 | |
| SCHEMBL3520478 | 0.73 | ATM (0.38) | POLBATMALDH1A1MAPTMEN1 | |
| Hydrochloric Acid SCHEMBL29143517 | 0.72 | MAPT (0.36) | POLBATMALDH1A1MAPTMEN1 | |
| SCHEMBL10502356 | 0.70 | ATM (0.39) | POLBATMALDH1A1MAPTMEN1 | |
| SCHEMBL22410854 | 0.70 | MAPT (0.36) | POLBATMALDH1A1MAPTMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-108884030-B | Improved labeling of nucleophiles using bipyridines | 安捷伦科技有限公司 | 2022-06-28 | — | — | CN | 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 |