Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.49 |
| ▸ | TSHR | P16473 | 2/20 | 0.47 |
| ▸ | PGK1 | P00558 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 2/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | UBE2N | P61088 | 1/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
| ▸ | HTR1A | P08908 | 4/20 | 0.44 |
| ▸ | ADRA1A | P35348 | 4/20 | 0.44 |
| ▸ | ADRA1D | P25100 | 2/20 | 0.44 |
| ▸ | ADRA1B | P35368 | 2/20 | 0.44 |
| ▸ | DRD2 | P14416 | 3/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.43 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.43 |
| ▸ | ADRA2B | P18089 | 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 | |
|---|---|---|---|---|
| SCHEMBL4072190 | 0.92 | L3MBTL1 (0.51) | L3MBTL1CYP2D6MEN1ALDH1A1CYP1A2 | |
| SCHEMBL12433870 | 0.77 | CHRM2 (0.51) | L3MBTL1ALDH1A1CYP1A2TSHRPOLB | |
| SCHEMBL11808662 | 0.74 | CHRM2 (0.46) | L3MBTL1ALDH1A1KMT2ATSHRPOLB | |
| SCHEMBL6402270 | 0.73 | KMT2A (0.50) | KMT2AHTR1ADRD2ADRA2CHTR2A | |
| SCHEMBL27982786 | 0.72 | TSHR (0.55) | L3MBTL1ALDH1A1TSHRPOLBHPGD | |
| Hydrochloric Acid SCHEMBL11676693 | 0.71 | DRD2 (0.60) | ALDH1A1KMT2ATSHRHTR1AADRA1A | |
| Hydrochloric Acid SCHEMBL9129540 | 0.71 | SLC29A1 (0.55) | CYP2D6MEN1KMT2ATSHRPGK1 | |
| SCHEMBL10831073 | 0.70 | KMT2A (0.47) | KMT2ATSHRHPGDNPSR1HTR2A | |
| SCHEMBL24277324 | 0.70 | CHRM2 (0.48) | L3MBTL1MEN1ALDH1A1KMT2ATSHR | |
| SCHEMBL24277459 | 0.70 | CHRM2 (0.48) | L3MBTL1MEN1ALDH1A1KMT2ATSHR |
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 |
|---|---|---|---|---|---|---|---|
| EP-2029543-B1 | SUBSTITUTED 3-CYANOPYRIDINES AS PROTEIN KINASE INHIBITORS | WYETH LLC (US) | 2015-11-18 | — | — | EP | disclosed |