Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.52 |
| ▸ | TP53 | P04637 | 1/20 | 0.52 |
| ▸ | TSHR | P16473 | 4/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | FAAH | O00519 | 1/20 | 0.31 |
| ▸ | BBOX1 | O75936 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL72850 | 0.97 | — | — | |
| SCHEMBL27802390 | 0.94 | — | — | |
| Hydrochloric Acid SCHEMBL27583419 | 0.91 | ALDH1A1 (0.50) | ALDH1A1TP53TSHRTDP1FAAH | |
| Aluminum Chloride Anhydrous SCHEMBL27583418 | 0.88 | ALDH1A1 (0.48) | ALDH1A1TP53TSHRTDP1 | |
| SCHEMBL77065 | 0.88 | — | — | |
| Formic Acid SCHEMBL28264955 | 0.86 | ALDH1A1 (0.46) | ALDH1A1TP53TSHRTDP1 | |
| Hypophosphorous Acid SCHEMBL11664036 | 0.86 | ALDH1A1 (0.46) | ALDH1A1TP53TSHRTDP1 | |
| SCHEMBL24243989 | 0.85 | TSHR (0.59) | ALDH1A1TP53TSHRTDP1FAAH | |
| SCHEMBL8624800 | 0.85 | TSHR (0.59) | ALDH1A1TP53TSHRTDP1FAAH | |
| SCHEMBL4970742 | 0.85 | TSHR (0.59) | ALDH1A1TP53TSHRTDP1FAAH |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-118125969-A | Haloperidol with excellent biological performance and preparation method and application thereof | 湖南洞庭药业股份有限公司 | 2024-06-04 | — | — | CN | claimed |
| CN-106380441-B | Synthetic method of fexofenadine intermediate | 上海雅本化学有限公司 | 2020-08-14 | — | — | CN | claimed |
| CN-118125969-A | Haloperidol with excellent biological performance and preparation method and application thereof | 湖南洞庭药业股份有限公司 | 2024-06-04 | — | — | CN | disclosed |
| CN-113548994-A | Preparation method of (S) -3- (2, 2, 2-trifluoroethyl) -pyrrolidine hydrochloride | 西安都创医药科技有限公司 | 2021-10-26 | — | — | CN | disclosed |
| CN-106795100-B | Compound, pharmaceutical composition and its purposes in treatment neurodegenerative disease | 里尔大学 | 2019-11-19 | — | — | CN | disclosed |
| CN-110049979-A | BROMODOMAIN INHIBITORS | 艾伯维公司 | 2019-07-23 | — | — | CN | disclosed |
| CN-107709316-A | The benzodioxan derivative of 2 (base of 1 heteroaryl piperazine 4) methyl 1,4 as α 2C antagonists | 奥赖恩公司 | 2018-02-16 | — | — | CN | disclosed |
| CN-106795100-A | Compound, pharmaceutical composition and its purposes in nerve degenerative diseases are treated | 法国里尔第二大学 | 2017-05-31 | — | — | CN | disclosed |
| CN-104098771-B | A kind of preparation method of the dissaving polymer with oxidoreduction response | 西北工业大学 | 2016-08-24 | — | — | CN | disclosed |