Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 2/20 | 0.41 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.40 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.38 |
| ▸ | MAPK3 | P27361 | 1/20 | 0.38 |
| ▸ | TAOK1 | Q7L7X3 | 1/20 | 0.38 |
| ▸ | PRKD2 | Q9BZL6 | 1/20 | 0.38 |
| ▸ | HCAR3 | P49019 | 2/20 | 0.38 |
| ▸ | GRM5 | P41594 | 1/20 | 0.38 |
| ▸ | GRM1 | Q13255 | 1/20 | 0.38 |
| ▸ | KIT | P10721 | 1/20 | 0.37 |
| ▸ | SRC | P12931 | 1/20 | 0.37 |
| ▸ | FLT3 | P36888 | 1/20 | 0.37 |
| ▸ | ITK | Q08881 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | KMO | O15229 | 3/20 | 0.36 |
| ▸ | JAK2 | O60674 | 1/20 | 0.36 |
| ▸ | JAK3 | P52333 | 1/20 | 0.36 |
| ▸ | KDR | P35968 | 1/20 | 0.35 |
| ▸ | TBK1 | Q9UHD2 | 1/20 | 0.35 |
| ▸ | ADORA3 | P0DMS8 | 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 | |
|---|---|---|---|---|
| SCHEMBL4802820 | 0.83 | DYRK1A (0.40) | MAPK1NOTUMMAPK3TAOK1PRKD2 | |
| SCHEMBL4801010 | 0.78 | CYP1A2 (0.55) | MAPK1KMO | |
| SCHEMBL31749286 | 0.77 | MAPK1 (0.51) | MAPK1NOTUMMAPK3TAOK1PRKD2 | |
| SCHEMBL5097315 | 0.76 | MAPK1 (0.66) | MAPK1NOTUMMAPK3TAOK1PRKD2 | |
| SCHEMBL29891279 | 0.76 | MAPK1 (0.66) | MAPK1NOTUMMAPK3TAOK1PRKD2 | |
| SCHEMBL14081621 | 0.74 | MAPK1 (0.74) | MAPK1MAPK3TAOK1PRKD2FLT3 | |
| SCHEMBL27405476 | 0.72 | TP53 (0.50) | MAPK1KMOJAK2JAK3ADORA3 | |
| SCHEMBL4851194 | 0.71 | KMT2A (0.40) | MAPK1NOTUMTDP1KMOKDR | |
| SCHEMBL13472371 | 0.70 | KMO (0.48) | HCAR3KMO | |
| SCHEMBL14081611 | 0.69 | MAPK1 (0.60) | MAPK1MAPK3TAOK1PRKD2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1611125-A1 | HETEROARYL SUBSTITUTED PYROLLS USEFUL AS INHIBITORS OF PROTEIN KINASES | Vertex Pharmaceuticals Incorporated (US) | 2006-01-04 | — | — | EP | disclosed |
| WO-2004072063-A1 | HETEROARYL SUBSTITUTED PYROLLS USEFUL AS INHIBITORS OF PROTEIN KINASES | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2004-08-26 | — | — | WO | disclosed |