Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.60 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.57 |
| ▸ | ALOX12 | P18054 | 4/20 | 0.57 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.57 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.57 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.57 |
| ▸ | TSHR | P16473 | 2/20 | 0.57 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.57 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.57 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.57 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.57 |
| ▸ | HTR2B | P41595 | 1/20 | 0.57 |
| ▸ | KCNH3 | Q9ULD8 | 1/20 | 0.56 |
| ▸ | HPGD | P15428 | 2/20 | 0.52 |
| ▸ | EPHX1 | P07099 | 3/20 | 0.52 |
| ▸ | HTT | P42858 | 2/20 | 0.52 |
| ▸ | MAPT | P10636 | 6/20 | 0.50 |
| ▸ | MEN1 | O00255 | 2/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.50 |
| ▸ | AR | P10275 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| Diphenylamine SCHEMBL27507095 | 1.00 | HSD17B10 (0.60) | HSD17B10ALDH1A1ALOX12L3MBTL1MAPK1 | |
| Diphenylamine SCHEMBL11181088 | 0.89 | KCNH3 (0.49) | HSD17B10ALDH1A1ALOX12L3MBTL1MAPK1 | |
| Tetrahexylammonium SCHEMBL27834988 | 0.89 | SLC22A1 (0.52) | HSD17B10ALDH1A1ALOX12L3MBTL1MAPK1 | |
| Octadecylamine SCHEMBL5861110 | 0.89 | DNM1 (0.52) | HSD17B10ALDH1A1ALOX12L3MBTL1MAPK1 | |
| Diphenylamine SCHEMBL3650060 | 0.89 | DNM1 (0.52) | HSD17B10ALDH1A1ALOX12L3MBTL1MAPK1 | |
| Diphenylamine SCHEMBL27639994 | 0.88 | KCNH2 (0.59) | HSD17B10ALDH1A1L3MBTL1PTGS1SLC6A2 | |
| Diphenylamine SCHEMBL8181869 | 0.88 | KCNH3 (0.47) | HSD17B10ALDH1A1ALOX12L3MBTL1MAPK1 | |
| Diphenylamine SCHEMBL1414440 | 0.87 | HSD17B10 (0.71) | HSD17B10ALDH1A1ALOX12L3MBTL1MAPK1 | |
| Diphenylamine SCHEMBL17729870 | 0.86 | DNM1 (0.54) | HSD17B10ALDH1A1ALOX12L3MBTL1MAPK1 | |
| SCHEMBL809713 | 0.86 | KCNH3 (0.63) | HSD17B10ALDH1A1ALOX12L3MBTL1MAPK1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109180478-A | Compound in diphenyl heptane class and its preparation method and application | 广东省中医院（广州中医药大学第二附属医院、广州中医药大学第二临床医学院、广东省中医药科学院） | 2019-01-11 | — | — | CN | disclosed |