Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 2/20 | 0.46 |
| ▸ | MMP9 | P14780 | 6/20 | 0.39 |
| ▸ | MMP2 | P08253 | 5/20 | 0.39 |
| ▸ | MMP1 | P03956 | 4/20 | 0.39 |
| ▸ | MMP8 | P22894 | 4/20 | 0.39 |
| ▸ | AURKA | O14965 | 1/20 | 0.38 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.36 |
| ▸ | P2RX7 | Q99572 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL3838984 | 1.00 | MAPK1 (0.46) | MAPK1MMP9MMP2MMP1MMP8 | |
| SCHEMBL3843091 | 0.84 | MEN1 (0.44) | MAPK1MMP9MMP2MMP1MMP8 | |
| SCHEMBL3845218 | 0.80 | MAPK1 (0.42) | MAPK1 | |
| SCHEMBL6643797 | 0.78 | MAPK1 (0.41) | MAPK1MMP9MMP2MMP1MMP8 | |
| SCHEMBL3843108 | 0.78 | MAPK1 (0.41) | MAPK1MMP9MMP2MMP1MMP8 | |
| SCHEMBL3838995 | 0.73 | CDK2 (0.42) | MAPK1MMP9MMP2MMP1MMP8 | |
| SCHEMBL3843570 | 0.73 | MEN1 (0.47) | MAPK1MMP9MMP2MMP1MMP8 | |
| SCHEMBL3841630 | 0.71 | CRHR1 (0.43) | MAPK1MMP9MMP2MMP1MMP8 | |
| SCHEMBL3842498 | 0.71 | AURKA (0.44) | MMP9MMP2MMP1MMP8AURKA | |
| SCHEMBL3841623 | 0.70 | CNR1 (0.40) | MAPK1AURKARPS6KB1MEN1ALDH1A1 |
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-1446387-A1 | SUBSTITUTED ARYL 1,4-PYRAZINE DERIVATIVES | PHARMACIA & UPJOHN COMPANY (US) | 2004-08-18 | — | — | EP | disclosed |
| WO-2003045924-A1 | SUBSTITUTED ARYL 1,4-PYRAZINE DERIVATIVES | PHARMACIA & UPJOHN COMPANY (US) | 2003-06-05 | — | — | WO | disclosed |