Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.55 |
| ▸ | TDP1 | Q9NUW8 | 7/20 | 0.55 |
| ▸ | ALOX12 | P18054 | 4/20 | 0.55 |
| ▸ | L3MBTL1 | Q9Y468 | 4/20 | 0.55 |
| ▸ | TSHR | P16473 | 4/20 | 0.55 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.55 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.55 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.55 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.55 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.55 |
| ▸ | HTR2B | P41595 | 1/20 | 0.55 |
| ▸ | MAPT | P10636 | 7/20 | 0.48 |
| ▸ | MEN1 | O00255 | 4/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.48 |
| ▸ | AR | P10275 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.44 |
| ▸ | HPGD | P15428 | 3/20 | 0.44 |
| ▸ | HTT | P42858 | 2/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL3174911 | 0.87 | HSD17B10 (0.33) | HSD17B10ALDH1A1TDP1ALOX12L3MBTL1 | |
| Diphenylamine SCHEMBL27795460 | 0.77 | HSD17B10 (0.67) | HSD17B10ALDH1A1TDP1ALOX12L3MBTL1 | |
| Diphenylamine SCHEMBL6828443 | 0.76 | HSD17B10 (1.00) | HSD17B10ALDH1A1TDP1ALOX12L3MBTL1 | |
| Diphenylamine SCHEMBL1619083 | 0.76 | HSD17B10 (1.00) | HSD17B10ALDH1A1TDP1ALOX12L3MBTL1 | |
| Diphenylamine SCHEMBL229 | 0.76 | HSD17B10 (1.00) | HSD17B10ALDH1A1TDP1ALOX12L3MBTL1 | |
| Diphenylamine SCHEMBL301493 | 0.76 | HSD17B10 (1.00) | HSD17B10ALDH1A1TDP1ALOX12L3MBTL1 | |
| Diphenylamine SCHEMBL3003404 | 0.76 | HSD17B10 (1.00) | HSD17B10ALDH1A1TDP1ALOX12L3MBTL1 | |
| SCHEMBL8842433 | 0.76 | RAPGEF4 (0.46) | ALDH1A1HTR2BMAPTMEN1KMT2A | |
| Diphenylamine SCHEMBL23295988 | 0.73 | HSD17B10 (0.92) | HSD17B10ALDH1A1TDP1ALOX12L3MBTL1 | |
| Diphenylamine SCHEMBL3357779 | 0.73 | HSD17B10 (0.92) | HSD17B10ALDH1A1TDP1ALOX12L3MBTL1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-107108646-A | Arunobacins and their use as antibacterial agents | 默沙东公司 | 2017-08-29 | — | — | CN | disclosed |
| EP-2076497-A1 | AMINOMETHYL-4-IMIDAZOLES | F. Hoffmann-Roche AG (CH) | 2009-07-08 | — | — | EP | disclosed |
| EP-2021316-A1 | INHIBITORS OF POLO-LIKE KINASES | Abbott Laboratories (US) | 2009-02-11 | — | — | EP | disclosed |
| WO-2008046757-A1 | AMINOMETHYL-4-IMIDAZOLES | F. HOFFMANN-LA ROCHE AG (CH) | 2008-04-24 | — | — | WO | disclosed |
| WO-2007140233-A1 | INHIBITORS OF POLO-LIKE KINASES | ABBOTT LABORATORIES (US) | 2007-12-06 | — | — | WO | disclosed |