Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.50 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.50 |
| ▸ | CES2 | O00748 | 3/20 | 0.46 |
| ▸ | CES1 | P23141 | 3/20 | 0.46 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.45 |
| ▸ | CA1 | P00915 | 2/20 | 0.43 |
| ▸ | CA2 | P00918 | 2/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.41 |
| ▸ | GSK3B | P49841 | 2/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
| ▸ | ERCC5 | P28715 | 1/20 | 0.40 |
| ▸ | FEN1 | P39748 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | NR4A1 | P22736 | 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 | |
|---|---|---|---|---|
| SCHEMBL4385239 | 0.80 | CES2 (0.46) | TSHRCES2CES1CA1CA2 | |
| SCHEMBL6677901 | 0.79 | TSHR (0.55) | TSHRSRD5A2HPGDMAPTKDM4E | |
| SCHEMBL18338013 | 0.75 | CES2 (0.50) | TSHRALOX15CES2CES1SRD5A2 | |
| SCHEMBL15601014 | 0.74 | KMT2A (0.52) | TSHRMAPK1L3MBTL1CYP3A4HPGD | |
| SCHEMBL9628068 | 0.73 | CES2 (0.48) | TSHRALOX15CES2CES1SRD5A2 | |
| SCHEMBL9064764 | 0.73 | CES2 (0.48) | TSHRALOX15CES2CES1SRD5A2 | |
| SCHEMBL3231737 | 0.73 | ALDH1A1 (0.47) | CES2CES1SRD5A2ATMHPGD | |
| SCHEMBL28953079 | 0.73 | MAPT (0.46) | CES2CES1CA1CA2MAPK1 | |
| SCHEMBL11303491 | 0.72 | HDAC4 (0.47) | TSHRALOX15CES2CES1SRD5A2 | |
| SCHEMBL5558534 | 0.72 | AKR1C1 (0.47) | TSHRCES2CES1HPGDALDH1A1 |
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-113317322-B | Soluble solution containing aryl formamide cyclopropanecarboxylic acid and preparation method thereof | 郑州郑氏化工产品有限公司 | 2022-04-05 | — | — | CN | disclosed |
| CN-113317322-A | Soluble solution containing aryl formamide cyclopropanecarboxylic acid and preparation method thereof | 郑州郑氏化工产品有限公司 | 2021-08-31 | — | — | CN | disclosed |