Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRAF | P15056 | 2/20 | 0.39 |
| ▸ | TNNI3K | Q59H18 | 2/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.36 |
| ▸ | CHEK1 | O14757 | 2/20 | 0.36 |
| ▸ | IRAK4 | Q9NWZ3 | 3/20 | 0.35 |
| ▸ | PLK4 | O00444 | 2/20 | 0.35 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.35 |
| ▸ | PRKD3 | O94806 | 2/20 | 0.35 |
| ▸ | MAP4K4 | O95819 | 2/20 | 0.35 |
| ▸ | CDK1 | P06493 | 2/20 | 0.35 |
| ▸ | FES | P07332 | 2/20 | 0.35 |
| ▸ | ROS1 | P08922 | 2/20 | 0.35 |
| ▸ | FGFR1 | P11362 | 2/20 | 0.35 |
| ▸ | PHKG2 | P15735 | 2/20 | 0.35 |
| ▸ | PRKACA | P17612 | 2/20 | 0.35 |
| ▸ | RPS6KB1 | P23443 | 2/20 | 0.35 |
| ▸ | CDK2 | P24941 | 2/20 | 0.35 |
| ▸ | MARK3 | P27448 | 2/20 | 0.35 |
| ▸ | FLT4 | P35916 | 2/20 | 0.35 |
| ▸ | FLT3 | P36888 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL14330947 | 0.80 | AKT1 (0.44) | BRAFTNNI3KCHEK1IRAK4PLK4 | |
| SCHEMBL24392119 | 0.79 | NOTUM (0.47) | BRAFTNNI3KMAPK1CHEK1IRAK4 | |
| SCHEMBL7885565 | 0.76 | MAPK1 (0.39) | BRAFTNNI3KMAPK1CHEK1IRAK4 | |
| SCHEMBL19306619 | 0.76 | BRAF (0.41) | BRAFTNNI3KMAPK1CHEK1IRAK4 | |
| SCHEMBL17401156 | 0.75 | MAP3K7 (0.56) | IRAK4ROCK2CHUKROCK1CDC42BPA | |
| SCHEMBL868756 | 0.73 | RET (0.41) | BRAFTNNI3KMAPK1CHEK1IRAK4 | |
| SCHEMBL22096107 | 0.72 | STK3 (0.61) | BRAFTNNI3KMAPK1CHEK1IRAK4 | |
| SCHEMBL154600 | 0.72 | CHEK1 (0.61) | BRAFTNNI3KMAPK1CHEK1DYRK1A | |
| SCHEMBL4005872 | 0.71 | PDPK1 (0.40) | BRAFTNNI3KMAPK1CHEK1IRAK4 | |
| SCHEMBL6469764 | 0.70 | BRAF (0.43) | BRAFTNNI3KMAPK1CHEK1IRAK4 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009080682-A1 | PYRROLO[2,3-D]PYRIMIDINE DERIVATIVES AS CGRP RECEPTOR ANTAGONISTS | GLAXO GROUP LIMITED (GB) | 2009-07-02 | — | — | WO | disclosed |
| WO-2009080682-A1 | PYRROLO[2,3-D]PYRIMIDINE DERIVATIVES AS CGRP RECEPTOR ANTAGONISTS | GLAXO GROUP LIMITED (GB) | 2009-07-02 | — | — | WO | disclosed |