Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AOC3 | Q16853 | 1/20 | 0.40 |
| ▸ | IDO1 | P14902 | 1/20 | 0.39 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | PARP1 | P09874 | 1/20 | 0.36 |
| ▸ | TACR1 | P25103 | 2/20 | 0.35 |
| ▸ | ACP3 | P15309 | 1/20 | 0.35 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL17844781 | 0.90 | AOC3 (0.39) | AOC3IDO1ADRA1DMEN1KMT2A | |
| SCHEMBL17844814 | 0.90 | AOC3 (0.39) | AOC3IDO1ADRA1DMEN1KMT2A | |
| SCHEMBL28622677 | 0.82 | AOC3 (0.47) | AOC3IDO1ADRA1DMEN1KMT2A | |
| SCHEMBL28622675 | 0.82 | AOC3 (0.47) | AOC3IDO1ADRA1DMEN1KMT2A | |
| SCHEMBL28040166 | 0.80 | AOC3 (0.46) | AOC3IDO1ADRA1DMEN1KMT2A | |
| SCHEMBL17860068 | 0.80 | TACR1 (0.44) | AOC3MEN1KMT2ATACR1ACP3 | |
| SCHEMBL21848091 | 0.78 | NOS2 (0.44) | AOC3IDO1ADRA1DPARP1CYP2D6 | |
| SCHEMBL19361662 | 0.76 | AOC3 (0.38) | AOC3MEN1KMT2ATACR1ACP3 | |
| SCHEMBL21848064 | 0.76 | AOC3 (0.42) | AOC3IDO1ADRA1DMEN1KMT2A | |
| SCHEMBL24729666 | 0.75 | AOC3 (0.40) | AOC3IDO1ADRA1DMEN1KMT2A |
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-2016095088-A1 | ERK INHIBITORS | MERCK SHARP & DOHME CORP. (US) | 2016-06-23 | — | — | WO | disclosed |