Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.48 |
| ▸ | CES2 | O00748 | 1/20 | 0.43 |
| ▸ | CES1 | P23141 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 5/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | PARP1 | P09874 | 2/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | RECQL | P46063 | 1/20 | 0.39 |
| ▸ | BLM | P54132 | 1/20 | 0.39 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | KIF11 | P52732 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 3/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.38 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| Chlorobenzene SCHEMBL27680836 | 0.87 | TSHR (0.48) | TSHRCES2CES1L3MBTL1MAPT | |
| Chlorobenzene SCHEMBL27488158 | 0.86 | TSHR (0.65) | TSHRCES2CES1L3MBTL1MAPT | |
| Chlorobenzene SCHEMBL27461533 | 0.86 | TSHR (0.65) | TSHRCES2CES1L3MBTL1MAPT | |
| Chlorobenzene SCHEMBL27634612 | 0.84 | TSHR (0.61) | TSHRCES2CES1L3MBTL1MAPT | |
| Maleic Acid SCHEMBL27640241 | 0.82 | HCAR2 (0.44) | TSHRCES2CES1L3MBTL1MAPT | |
| Chlorobenzene SCHEMBL9576941 | 0.81 | TSHR (0.65) | TSHRCES2CES1L3MBTL1MAPT | |
| Pyrrole SCHEMBL5142032 | 0.78 | — | — | |
| Chlorobenzene SCHEMBL27931356 | 0.77 | TSHR (0.52) | TSHRCES2CES1L3MBTL1MAPT | |
| Chlorobenzene SCHEMBL10495752 | 0.77 | TSHR (0.58) | TSHRCES2CES1L3MBTL1MAPT | |
| Chlorobenzene SCHEMBL27555909 | 0.77 | TSHR (0.58) | TSHRCES2CES1L3MBTL1MAPT |
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-109105377-A | The growth regulator and preparation method thereof of Exocarpium Citri Rubrum flower and fruit protecting | 平果县天然润宝农业发展有限公司 | 2019-01-01 | — | — | CN | disclosed |