Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 1/20 | 0.51 |
| ▸ | MAPT | P10636 | 7/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | HTT | P42858 | 1/20 | 0.50 |
| ▸ | RAB9A | P51151 | 1/20 | 0.49 |
| ▸ | PRKDC | P78527 | 1/20 | 0.49 |
| ▸ | FGFR2 | P21802 | 1/20 | 0.48 |
| ▸ | FGFR3 | P22607 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | PKM | P14618 | 1/20 | 0.46 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.45 |
| ▸ | FAAH | O00519 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.44 |
| ▸ | ABCB1 | P08183 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL19475144 | 0.86 | LMNA (0.54) | AKR1C3MAPTKDM4EALDH1A1HTT | |
| SCHEMBL5448570 | 0.84 | ADRB1 (0.61) | AKR1C3MAPTKDM4EALDH1A1HTT | |
| SCHEMBL3914229 | 0.82 | AKR1C3 (0.51) | AKR1C3MAPTKDM4EALDH1A1HTT | |
| SCHEMBL15546841 | 0.79 | KMO (0.57) | AKR1C3MAPTKDM4EALDH1A1MEN1 | |
| SCHEMBL11963589 | 0.78 | MAPT (0.54) | AKR1C3MAPTKDM4EALDH1A1HTT | |
| SCHEMBL27922475 | 0.78 | KDM4E (0.52) | AKR1C3MAPTKDM4EALDH1A1HTT | |
| SCHEMBL9231063 | 0.77 | PRKDC (0.51) | AKR1C3MAPTKDM4EALDH1A1HTT | |
| SCHEMBL29833111 | 0.77 | PRKDC (0.51) | AKR1C3MAPTKDM4EALDH1A1HTT | |
| SCHEMBL5123031 | 0.77 | PRKDC (0.51) | AKR1C3MAPTKDM4EALDH1A1HTT | |
| SCHEMBL28304654 | 0.77 | L3MBTL1 (0.62) | AKR1C3MAPTKDM4EALDH1A1HTT |
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 |
|---|---|---|---|---|---|---|---|
| WO-2017184589-A1 | A VERSATILE LIGAND FOR PALLADIUM-CATALYZED META-C-H FUNCTIONALIZATIONS | THE SCRIPPS RESEARCH INSTITUTE (US) | 2017-10-26 | — | — | WO | disclosed |