Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 2/20 | 0.45 |
| ▸ | CDC25B | P30305 | 6/20 | 0.44 |
| ▸ | CDC25A | P30304 | 5/20 | 0.44 |
| ▸ | MAP2K7 | O14733 | 4/20 | 0.44 |
| ▸ | TDP2 | O95551 | 1/20 | 0.44 |
| ▸ | G6PD | P11413 | 1/20 | 0.44 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.44 |
| ▸ | HKDC1 | Q2TB90 | 1/20 | 0.44 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.44 |
| ▸ | IDO1 | P14902 | 3/20 | 0.44 |
| ▸ | MAOA | P21397 | 3/20 | 0.44 |
| ▸ | MAOB | P27338 | 3/20 | 0.44 |
| ▸ | SNCA | P37840 | 2/20 | 0.44 |
| ▸ | AKT1 | P31749 | 1/20 | 0.44 |
| ▸ | MAP2K1 | Q02750 | 1/20 | 0.44 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.44 |
| ▸ | EHMT2 | Q96KQ7 | 1/20 | 0.44 |
| ▸ | NSD1 | Q96L73 | 1/20 | 0.44 |
| ▸ | EHMT1 | Q9H9B1 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL1243588 | 0.87 | BACE1 (0.52) | BACE1CDC25BCDC25AMAP2K7TDP2 | |
| SCHEMBL30172862 | 0.87 | BACE1 (0.52) | BACE1CDC25BCDC25AMAP2K7TDP2 | |
| SCHEMBL28293793 | 0.87 | MAPT (0.55) | CDC25BTDP2HKDC1ALDH1A1MAPT | |
| SCHEMBL28796660 | 0.78 | TTR (0.43) | MAP2K7ALDH1A1MAPTHPGDLMNA | |
| SCHEMBL30895284 | 0.74 | MAOA (0.50) | MAOAMAOBALDH1A1LMNAMEN1 | |
| SCHEMBL503745 | 0.74 | MAOA (0.50) | MAOAMAOBALDH1A1LMNAMEN1 | |
| SCHEMBL31315022 | 0.74 | CDC25B (0.55) | CDC25BCDC25AMAP2K7TDP2G6PD | |
| SCHEMBL15514574 | 0.74 | CDC25B (0.55) | CDC25BCDC25AMAP2K7TDP2G6PD | |
| SCHEMBL27881077 | 0.74 | S100A4 (0.45) | ALDH1A1SMN1; SMN2MEN1KMT2AS100A4 | |
| SCHEMBL27864867 | 0.74 | CA1 (0.43) | ALDH1A1CYP3A4HPGDLMNAMEN1 |
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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113966271-A | Agent capable of reacting with or removing oxygen molecules | 李蓁蓁 | 2022-01-21 | — | — | CN | disclosed |
| CN-103554021-A | Indanone tetrahydroisoquinoline derivative as well as preparation method and medical application thereof | UNIV CHINA PHARMA | 2014-02-05 | — | — | CN | disclosed |
| CN-102603520-A | Method for preparing 1H-indene-1-ketone-3-methanoic acid compound | UNIV CHINA PHARMA | 2012-07-25 | — | — | CN | disclosed |
| US-5756730-A | Process for preparing analgesic compounds | SANKYO COMPANY, LIMITED (JP) | 1998-05-26 | — | — | US | disclosed |
| US-5656758-A | AMIDATION OF AN AMINE-CONTAINING THIOMORPHOLINE OR PIPERAZINE COMPOUND | SANKYO COMPANY, LIMITED (JP) | 1997-08-12 | — | — | US | disclosed |
| US-5512567-A | KAPPA-RECEPTOR AGONISTS | SANKYO COMPANY, LIMITED (JP) | 1996-04-30 | — | — | US | disclosed |
| US-5270327-A | Piperidine derivatives | SANKYO COMPANY, LIMITED (JP) | 1993-12-14 | — | — | US | disclosed |
| EP-0356247-B1 | ANALGESIC CARBOXYLIC ACID AMIDE DERIVATIVES | Sankyo Company Limited (JP) | 1993-03-17 | — | — | EP | disclosed |
| US-5021413-A | Analgesic thiomorpholins their preparation, and pharmaceutical compositions containing them | SANKYO COMPANY LIMITED (JP) | 1991-06-04 | — | — | US | disclosed |
| EP-0356247-A1 | Analgesic carboxylic acid amide derivatives | Sankyo Company Limited (JP) | 1990-02-28 | — | — | EP | disclosed |