Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.48 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.48 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.48 |
| ▸ | TSHR | P16473 | 2/20 | 0.48 |
| ▸ | MAPT | P10636 | 2/20 | 0.48 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | USP2 | O75604 | 1/20 | 0.48 |
| ▸ | HPN | P05981 | 1/20 | 0.48 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.48 |
| ▸ | THRB | P10828 | 1/20 | 0.48 |
| ▸ | PDE4A | P27815 | 1/20 | 0.48 |
| ▸ | KDR | P35968 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
| ▸ | SIRT5 | Q9NXA8 | 1/20 | 0.48 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.48 |
| ▸ | MAPKAPK2 | P49137 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL5094900 | 0.86 | MAOA (0.59) | ALDH1A1ALOX15HSD17B10TDP1CYP3A4 | |
| SCHEMBL5539483 | 0.83 | MEN1 (0.47) | ALDH1A1ALOX15HSD17B10TDP1CYP3A4 | |
| SCHEMBL28957589 | 0.80 | MAPKAPK2 (0.46) | ALDH1A1ALOX15HSD17B10TDP1CYP3A4 | |
| SCHEMBL4051989 | 0.76 | ALDH1A1 (0.41) | ALDH1A1ALOX15HSD17B10TDP1CYP3A4 | |
| SCHEMBL7111010 | 0.76 | MAPT (0.41) | ALDH1A1ALOX15HSD17B10TDP1CYP3A4 | |
| SCHEMBL6874304 | 0.74 | MAPKAPK2 (0.35) | ALDH1A1ALOX15HSD17B10TDP1CYP3A4 | |
| SCHEMBL2052908 | 0.73 | PARP1 (0.56) | ALDH1A1ALOX15HSD17B10TDP1CYP3A4 | |
| SCHEMBL29577247 | 0.73 | DRD2 (0.35) | ALDH1A1ALOX15HSD17B10TDP1CYP3A4 | |
| SCHEMBL16283615 | 0.73 | PTGS1 (0.41) | ALDH1A1ALOX15HSD17B10TDP1CYP3A4 | |
| SCHEMBL12023167 | 0.72 | ALDH1A1 (0.74) | ALDH1A1ALOX15HSD17B10TDP1CYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2005063730-A1 | METHOD FOR THE PRODUCTION OF XANTHENE-4,5-DIOLES SUBSTITUTED IN POSITION 2.7 | BASF AKTIENGESELLSCHAFT (DE) | 2005-07-14 | — | — | WO | claimed |
| WO-2005051380-A1 | SUBSTITUTED UREA-OCTAHYDROINDOLS AS ANTAGONISTS OF MELANIN CONCENTRATING HORMONE RECEPTOR 1 (MCH1R) | BIOVITRUM AB (SE) | 2005-06-09 | — | — | WO | claimed |
| CN-104854091-B | The amine derivative of 5 fluorine N (base of pyridine 2) pyridine 2 containing sulfone group | 拜耳药业股份公司 | 2018-04-03 | — | — | CN | disclosed |
| CN-107652303-A | New Thienopyrimidine derivative, its preparation method and its therapeutical uses | 赛诺菲 | 2018-02-02 | — | — | CN | disclosed |
| CN-104540834-B | Novel thienopyrimidine derivatives, preparation method and therapeutic use thereof | 赛诺菲 | 2017-11-14 | — | — | CN | disclosed |
| CN-107108534-A | Probes for Imaging Huntingtin | CHDI基金会股份有限公司 | 2017-08-29 | — | — | CN | disclosed |
| CN-105102444-B | Sulfomimino-containing 5-fluoro-N- (pyridin-2-yl) pyridin-2-amine derivatives | 拜耳医药股份有限公司 | 2017-08-01 | — | — | CN | disclosed |
| CN-104918932-B | The amine derivative of N (base of pyridine 2) pyrimidine 4 of the imine group containing sulphur | 拜耳药业股份公司 | 2017-07-18 | — | — | CN | disclosed |
| WO-2005063730-A1 | METHOD FOR THE PRODUCTION OF XANTHENE-4,5-DIOLES SUBSTITUTED IN POSITION 2.7 | BASF AKTIENGESELLSCHAFT (DE) | 2005-07-14 | — | — | WO | disclosed |
| WO-2005063730-A1 | METHOD FOR THE PRODUCTION OF XANTHENE-4,5-DIOLES SUBSTITUTED IN POSITION 2.7 | BASF AKTIENGESELLSCHAFT (DE) | 2005-07-14 | — | — | WO | disclosed |