Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 3/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | DHODH | Q02127 | 3/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.39 |
| ▸ | GLO1 | Q04760 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 4/20 | 0.38 |
| ▸ | MAPT | P10636 | 4/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 3/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL24170700 | 0.75 | CYP2D6 (0.55) | CYP2D6ALDH1A1SMN1; SMN2DHODHNPSR1 | |
| SCHEMBL21786019 | 0.75 | CYP2D6 (0.55) | CYP2D6ALDH1A1SMN1; SMN2DHODHNPSR1 | |
| SCHEMBL24170368 | 0.73 | CYP2D6 (0.49) | CYP2D6ALDH1A1SMN1; SMN2DHODHNPSR1 | |
| SCHEMBL9326451 | 0.71 | CYP2D6 (0.58) | CYP2D6ALDH1A1SMN1; SMN2DHODHNPSR1 | |
| SCHEMBL9777789 | 0.70 | GLO1 (0.55) | CYP2D6ALDH1A1SMN1; SMN2DHODHNPSR1 | |
| SCHEMBL30096059 | 0.70 | GLO1 (0.50) | CYP2D6ALDH1A1SMN1; SMN2DHODHNPSR1 | |
| SCHEMBL25669817 | 0.70 | GLO1 (0.40) | CYP2D6ALDH1A1SMN1; SMN2DHODHNPSR1 | |
| SCHEMBL26084789 | 0.70 | CYP2D6 (0.56) | CYP2D6ALDH1A1SMN1; SMN2DHODHNPSR1 | |
| SCHEMBL24170109 | 0.69 | CYP2D6 (0.47) | CYP2D6ALDH1A1SMN1; SMN2DHODHNPSR1 | |
| SCHEMBL24170016 | 0.68 | CYP2D6 (0.46) | CYP2D6ALDH1A1SMN1; SMN2DHODHNPSR1 |
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-2017172596-A1 | PYRROLOTRIAZINE COMPOUNDS AS TAM INHIBITORS | INCYTE CORPORATION (US) | 2017-10-05 | — | — | WO | disclosed |