Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR4A1 | P22736 | 1/20 | 0.47 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.47 |
| ▸ | NR4A3 | Q92570 | 1/20 | 0.47 |
| ▸ | CHAT | P28329 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.43 |
| ▸ | CA1 | P00915 | 1/20 | 0.43 |
| ▸ | CA2 | P00918 | 1/20 | 0.43 |
| ▸ | ACACB | O00763 | 1/20 | 0.42 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.42 |
| ▸ | CDC25B | P30305 | 1/20 | 0.42 |
| ▸ | GRM5 | P41594 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | HTT | P42858 | 2/20 | 0.40 |
| ▸ | WDR5 | P61964 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | MITF | O75030 | 1/20 | 0.40 |
| ▸ | RAD52 | P43351 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL29749080 | 1.00 | NR4A1 (0.47) | NR4A1NR4A2NR4A3CHATTDP1 | |
| SCHEMBL30772315 | 0.81 | HSP90AA1 (0.48) | TDP1CA1CA2PTPN1MAPT | |
| SCHEMBL6561814 | 0.79 | PLK1 (0.49) | NR4A1NR4A2NR4A3CHATCA1 | |
| SCHEMBL29661843 | 0.79 | CHAT (0.60) | CHATTDP1CA1CA2ACACB | |
| SCHEMBL2776015 | 0.79 | CHAT (0.60) | CHATTDP1CA1CA2ACACB | |
| SCHEMBL3130959 | 0.78 | NR4A1 (0.63) | NR4A1NR4A2NR4A3CHATTDP1 | |
| SCHEMBL5881377 | 0.77 | CA1 (0.50) | NR4A1NR4A2NR4A3CHATTDP1 | |
| SCHEMBL6364668 | 0.77 | CHAT (0.58) | CHATTDP1CA1CA2ACACB | |
| SCHEMBL5881381 | 0.75 | CHAT (0.49) | NR4A1NR4A2NR4A3CHATTDP1 | |
| SCHEMBL5881479 | 0.75 | CHAT (0.49) | CHATTDP1CA1CA2ACACB |
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 16 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113548965-B | Preparation method of 1,4 eneyne compound | 南京工业大学 | 2022-07-26 | — | — | CN | claimed |
| CN-113429285-B | Method for synthesizing hydroxyacetone ester compounds based on methylene aziridine | 潍坊科技学院 | 2021-12-07 | — | — | CN | claimed |
| CN-113548965-A | Preparation method of 1, 4-eneyne compound | 南京工业大学 | 2021-10-26 | — | — | CN | claimed |
| CN-113429285-A | Method for synthesizing hydroxyacetone ester compounds based on methylene aziridine | 潍坊科技学院 | 2021-09-24 | — | — | CN | claimed |
| CN-115286555-A | Synthetic method of 3-alkynylselendole compound | 温州医科大学 | 2022-11-04 | — | — | CN | disclosed |
| CN-113548965-B | Preparation method of 1,4 eneyne compound | 南京工业大学 | 2022-07-26 | — | — | CN | disclosed |
| CN-113349200-B | Application of magnolol and honokiol as pesticide synergist | 中国水稻研究所 | 2022-05-24 | — | — | CN | disclosed |
| CN-113429285-B | Method for synthesizing hydroxyacetone ester compounds based on methylene aziridine | 潍坊科技学院 | 2021-12-07 | — | — | CN | disclosed |
| CN-113548965-A | Preparation method of 1, 4-eneyne compound | 南京工业大学 | 2021-10-26 | — | — | CN | disclosed |
| CN-113429285-A | Method for synthesizing hydroxyacetone ester compounds based on methylene aziridine | 潍坊科技学院 | 2021-09-24 | — | — | CN | disclosed |
| CN-113349200-A | Application of magnolol and honokiol as pesticide synergist | 中国水稻研究所 | 2021-09-07 | — | — | CN | disclosed |
| US-6300340-B1 | USEFUL FOR THERAPY OF CANCER AND SOLID TUMORS | ADIR ET COMPAGNIE (FR) | 2001-10-09 | — | — | US | disclosed |
| EP-1091958-A1 | SALTS OF PAROXETINE | SMITHKLINE BEECHAM PLC (GB) | 2001-04-18 | — | — | EP | disclosed |
| US-6162822-A | Bisimide compounds | ADIR ET COMPAGNIE (FR) | 2000-12-19 | — | — | US | disclosed |
| WO-2000001692-A1 | SALTS OF PAROXETINE | SMITHKLINE BEECHAM PLC (GB) | 2000-01-13 | — | — | WO | disclosed |
| US-5854273-A | Bisimide compounds | ADIR ET COMPAGNIE (FR) | 1998-12-29 | — | — | US | disclosed |