Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AOC3 | Q16853 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | IDO1 | P14902 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | PARP1 | P09874 | 1/20 | 0.35 |
| ▸ | TACR1 | P25103 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL17844814 | 1.00 | AOC3 (0.39) | AOC3MEN1KMT2AIDO1CYP2D6 | |
| SCHEMBL17844774 | 0.90 | AOC3 (0.40) | AOC3MEN1KMT2AIDO1CYP2D6 | |
| SCHEMBL17844741 | 0.82 | MAPT (0.39) | AOC3MEN1KMT2AIDO1CYP2D6 | |
| SCHEMBL28622677 | 0.80 | AOC3 (0.47) | AOC3MEN1KMT2AIDO1ADRA1D | |
| SCHEMBL28622675 | 0.80 | AOC3 (0.47) | AOC3MEN1KMT2AIDO1ADRA1D | |
| SCHEMBL17860065 | 0.78 | TACR1 (0.44) | AOC3CYP2D6TACR1 | |
| SCHEMBL28040166 | 0.78 | AOC3 (0.46) | AOC3MEN1KMT2AIDO1ADRA1D | |
| SCHEMBL21848091 | 0.76 | NOS2 (0.44) | AOC3IDO1CYP2D6ADRA1DPARP1 | |
| SCHEMBL17846018 | 0.75 | ALDH1A1 (0.40) | MEN1KMT2ACYP2D6GAATSHR | |
| SCHEMBL21848064 | 0.74 | AOC3 (0.42) | AOC3MEN1KMT2AIDO1CYP2D6 |
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 |