Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | CACNA2D1 | P54289 | 2/20 | 0.40 |
| ▸ | CACNB3 | P54284 | 1/20 | 0.40 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.40 |
| ▸ | PGR | P06401 | 1/20 | 0.40 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.40 |
| ▸ | HTR2B | P41595 | 1/20 | 0.40 |
| ▸ | CACNA2D2 | Q9NY47 | 1/20 | 0.40 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 3/20 | 0.36 |
| ▸ | SLC15A2 | Q16348 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | GABRR1 | P24046 | 2/20 | 0.32 |
| ▸ | MME | P08473 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL14513819 | 0.89 | ALDH1A1 (0.50) | TDP1ALDH1A1LMNASLC15A2 | |
| SCHEMBL28363512 | 0.87 | TDP1 (0.48) | TDP1ALDH1A1CACNA2D1CACNB3CACNA1C | |
| SCHEMBL619735 | 0.87 | SLC22A6 (0.47) | TDP1CACNA2D1CACNB3CACNA1CPGR | |
| Acetone SCHEMBL28340425 | 0.84 | CACNA2D1 (0.43) | TDP1ALDH1A1CACNA2D1CACNB3CACNA1C | |
| SCHEMBL9734057 | 0.84 | — | — | |
| SCHEMBL45197 | 0.81 | — | — | |
| SCHEMBL8055157 | 0.80 | TDP1 (0.42) | TDP1ALDH1A1CACNA2D1CACNB3CACNA1C | |
| SCHEMBL11519298 | 0.79 | LMNA (0.42) | TDP1ALDH1A1CACNA2D1CACNB3CACNA1C | |
| Alcohol SCHEMBL28947608 | 0.79 | CACNA2D1 (0.43) | TDP1ALDH1A1CACNA2D1CACNB3CACNA1C | |
| SCHEMBL5165804 | 0.78 | SLC22A6 (0.45) | TDP1CACNA2D1CACNB3CACNA1CPGR |
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 11 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110873766-A | Mass spectrometry method for screening protein with structure and interaction change caused by drug | 中国科学院大连化学物理研究所 | 2020-03-10 | — | — | CN | disclosed |
| EP-2360152-A1 | TWO TYPES OF CRYSTALLINE OF PINOCEMBRIN: A AND B, THEIR PREPARATION AND THEIR USE FOR MANUFACTURE OF PHARMACEUTICAL COMPOSITIONS | CSPC Zhongqi Pharmaceutical Technology (Shijiazhuang) Co., Ltd. (CN) | 2011-08-24 | — | — | EP | disclosed |
| EP-0708837-B1 | FLUORESCENT POLYMER LABELED CONJUGATES AND INTERMEDIATES | ABBOTT LAB (US) | 2006-03-08 | — | — | EP | disclosed |
| EP-0708837-A4 | FLUORESCENT POLYMER LABELED CONJUGATES AND INTERMEDIATES | ABBOTT LAB (US) | 2002-11-20 | — | — | EP | disclosed |
| WO-1999031511-A1 | IMMUNOASSAY FOR HORMONE DETECTION | STICHTING INSTITUUT VOOR DIERHOUDERIJ EN DIERGEZONDHEID (NL) | 1999-06-24 | — | — | WO | disclosed |
| US-5661040-A | RECEPTOR BINDING ASSAYS | ABBOTT LABORATORIES (US) | 1997-08-26 | — | — | US | disclosed |
| US-5639904-A | CARDIOVASCULAR DISORDERS | PRODESFARMA, S.A. (ES) | 1997-06-17 | — | — | US | disclosed |
| EP-0708837-A1 | FLUORESCENT POLYMER LABELED CONJUGATES AND INTERMEDIATES | ABBOTT LABORATORIES (US) | 1996-05-01 | — | — | EP | disclosed |
| US-5502237-A | VASODILATORS, ADRENERGIC BLOCKING AGENTS | PRODESFARMA, S. A. (ES) | 1996-03-26 | — | — | US | disclosed |
| WO-1995002700-A1 | FLUORESCENT POLYMER LABELED CONJUGATES AND INTERMEDIATES | ABBOTT LABORATORIES (US) | 1995-01-26 | — | — | WO | disclosed |
| US-4255564-A | ANTIBIOTICS, PROTECTED ALDEHYDE GROUP, INTERMEDIATES | ZAIDAN HOJIN BISEIBUTSU KAGAKU KENKYU KAI (JP) | 1981-03-10 | — | — | US | disclosed |