Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
| ▸ | RECQL | P46063 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.44 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.44 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 5/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.43 |
| ▸ | MAPT | P10636 | 4/20 | 0.43 |
| ▸ | HTT | P42858 | 2/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | DDX3X | O00571 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL8669001 | 0.79 | HSP90AA1 (0.65) | HSP90AA1LMNASMN1; SMN2ALDH1A1MEN1 | |
| SCHEMBL2878642 | 0.78 | PTGS1 (0.55) | CYP2D6CYP2C9CYP2C19RECQLLMNA | |
| SCHEMBL1224992 | 0.77 | TRPM5 (0.54) | CYP2C19SMN1; SMN2ALDH1A1MEN1KMT2A | |
| SCHEMBL31426653 | 0.77 | ALDH1A1 (0.43) | CYP2C9CYP2C19RECQLALDH1A1MAPT | |
| SCHEMBL9270830 | 0.77 | ALDH1A1 (0.43) | CYP2C9CYP2C19RECQLALDH1A1MAPT | |
| SCHEMBL5094461 | 0.75 | ALDH1A1 (0.52) | LMNASMN1; SMN2ALDH1A1KMT2AMAPT | |
| SCHEMBL27679166 | 0.74 | ALDH1A1 (0.59) | CYP2D6CYP2C9CYP2C19RECQLLMNA | |
| SCHEMBL657614 | 0.74 | ALDH1A1 (0.59) | CYP2D6CYP2C9CYP2C19RECQLLMNA | |
| SCHEMBL15054365 | 0.74 | ALDH1A1 (0.52) | CYP2D6CYP2C9CYP2C19RECQLLMNA | |
| SCHEMBL6418114 | 0.73 | HSP90AA1 (0.53) | HSP90AA1CYP2C9LMNASMN1; SMN2ALDH1A1 |
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-2016009306-A1 | HETEROCYCLYL COMPOUNDS AS MEK INHIBITORS | LUPIN LIMITED (IN) | 2016-01-21 | — | — | WO | disclosed |