Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 1/20 | 0.48 |
| ▸ | MAOB | P27338 | 1/20 | 0.48 |
| ▸ | LIMK1 | P53667 | 2/20 | 0.45 |
| ▸ | IKBKB | O14920 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 7/20 | 0.45 |
| ▸ | NPC1 | O15118 | 3/20 | 0.45 |
| ▸ | RAB9A | P51151 | 3/20 | 0.45 |
| ▸ | HPGD | P15428 | 3/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.42 |
| ▸ | MEN1 | O00255 | 5/20 | 0.42 |
| ▸ | POLB | P06746 | 3/20 | 0.42 |
| ▸ | GAA | P10253 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.41 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.39 |
| ▸ | NFKB1 | P19838 | 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 | |
|---|---|---|---|---|
| SCHEMBL28824618 | 0.99 | MAOA (0.49) | MAOAMAOBLIMK1IKBKBMAPT | |
| Alcohol SCHEMBL28044921 | 0.92 | MAPT (0.44) | MAOAMAOBLIMK1IKBKBMAPT | |
| SCHEMBL3257120 | 0.82 | MAOA (0.49) | MAOAMAOBLIMK1IKBKBMAPT | |
| SCHEMBL852095 | 0.81 | MAOA (0.48) | MAOAMAOBLIMK1IKBKBMAPT | |
| SCHEMBL9811801 | 0.79 | MAOB (0.50) | MAOAMAOBMAPTNPC1RAB9A | |
| SCHEMBL10941770 | 0.78 | LIMK1 (0.46) | MAOAMAOBLIMK1IKBKBMAPT | |
| SCHEMBL28910311 | 0.77 | MAOB (0.48) | MAOAMAOBMAPTNPC1RAB9A | |
| SCHEMBL7115218 | 0.73 | LIMK1 (0.50) | LIMK1IKBKBMAPTHPGDKMT2A | |
| SCHEMBL8663885 | 0.73 | MAPT (0.44) | MAOAMAOBMAPTNPC1RAB9A | |
| SCHEMBL8440726 | 0.72 | MAPT (0.52) | MAOAMAOBMAPTNPC1RAB9A |
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-105503901-B | A kind of thioxanthone dicarboxylic acid diamides and its preparation method and application | 广州纽楷美新材料科技有限公司 | 2018-10-19 | — | — | CN | disclosed |
| CN-105503901-A | Thioxanthone dicarboamide compound and preparing method and application thereof | HE MINGHUI | 2016-04-20 | — | — | CN | disclosed |