Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | VNN1 | O95497 | 1/20 | 0.39 |
| ▸ | MAPK14 | Q16539 | 2/20 | 0.38 |
| ▸ | GAK | O14976 | 1/20 | 0.38 |
| ▸ | LCK | P06239 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.38 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.38 |
| ▸ | EPHA5 | P54756 | 1/20 | 0.38 |
| ▸ | MAPK11 | Q15759 | 1/20 | 0.38 |
| ▸ | ABCB1 | P08183 | 4/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 7/20 | 0.35 |
| ▸ | MAOB | P27338 | 1/20 | 0.35 |
| ▸ | MAP2K4 | P45985 | 1/20 | 0.35 |
| ▸ | TTK | P33981 | 1/20 | 0.34 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | ADCY1 | Q08828 | 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 | |
|---|---|---|---|---|
| SCHEMBL7473151 | 0.89 | MAPK14 (0.39) | VNN1MAPK14GAKLCKCYP3A4 | |
| SCHEMBL7481490 | 0.88 | MAPK14 (0.38) | VNN1MAPK14GAKLCKCYP3A4 | |
| SCHEMBL7475255 | 0.81 | MAPK14 (0.57) | VNN1MAPK14GAKLCKCYP3A4 | |
| SCHEMBL7472121 | 0.81 | MAPK14 (0.57) | VNN1MAPK14GAKLCKCYP3A4 | |
| SCHEMBL7473487 | 0.81 | VNN1 (0.49) | VNN1MAP2K4KDM4EADCY1 | |
| SCHEMBL7478461 | 0.80 | HTT (0.44) | VNN1MAPK14GAKLCKCYP3A4 | |
| SCHEMBL7476789 | 0.80 | FABP4 (0.44) | VNN1MAPK14GAKLCKCYP3A4 | |
| SCHEMBL7469535 | 0.78 | MAPK14 (0.40) | VNN1MAPK14GAKLCKCYP3A4 | |
| SCHEMBL7471940 | 0.77 | VNN1 (0.39) | VNN1MAPK14GAKLCKCYP3A4 | |
| SCHEMBL7476793 | 0.76 | MAPK1 (0.41) | VNN1MAPK1MAP2K4KDM4EADCY1 |
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-1218346-A1 | PYRAZOLE DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 2002-07-03 | — | — | EP | disclosed |
| WO-2001021591-A1 | PYRAZOLE DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 2001-03-29 | — | — | WO | disclosed |