Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | KCNA5 | P22460 | 1/20 | 0.42 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | CTRC | Q99895 | 1/20 | 0.40 |
| ▸ | ACP3 | P15309 | 1/20 | 0.40 |
| ▸ | ACHE | P22303 | 1/20 | 0.39 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | SLC18A2 | Q05940 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| Fluoride SCHEMBL27516281 | 0.87 | CYP1A2 (0.56) | L3MBTL1CYP1A2CYP2C19CYP2C9CYP2D6 | |
| SCHEMBL248239 | 0.84 | CYP1A2 (0.58) | L3MBTL1CYP1A2CYP2C19CYP2C9CYP2D6 | |
| SCHEMBL29354720 | 0.84 | CYP1A2 (0.58) | L3MBTL1CYP1A2CYP2C19CYP2C9CYP2D6 | |
| Naphthalen-1-Yl-Methanol SCHEMBL971788 | 0.84 | L3MBTL1 (0.47) | L3MBTL1CYP1A2CYP2C19CYP2C9KCNA5 | |
| Ammonia Solution, Strong SCHEMBL5431159 | 0.82 | CYP1A2 (0.56) | L3MBTL1CYP1A2CYP2C19CYP2C9CYP2D6 | |
| SCHEMBL7275960 | 0.82 | CYP1A2 (0.56) | L3MBTL1CYP1A2CYP2C19CYP2C9CYP2D6 | |
| Hydrochloric Acid SCHEMBL6011728 | 0.82 | CYP1A2 (0.56) | L3MBTL1CYP1A2CYP2C19CYP2C9CYP2D6 | |
| Ammonia Solution, Strong SCHEMBL11771188 | 0.81 | CYP1A2 (0.54) | L3MBTL1CYP1A2CYP2C19CYP2C9CYP2D6 | |
| Tetrahydrofuran SCHEMBL29135748 | 0.79 | L3MBTL1 (0.43) | L3MBTL1CYP1A2CYP2C19CYP2C9KCNA5 | |
| Tetrahydrofuran SCHEMBL971564 | 0.79 | KCNA5 (0.46) | L3MBTL1CYP1A2CYP2C19CYP2C9KCNA5 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-104055756-B | The derivant of naftifine hydrochloride, Preparation method and use | 中国科学院上海药物研究所 | 2016-10-05 | — | — | CN | disclosed |