Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 5/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.44 |
| ▸ | CLK4 | Q9HAZ1 | 4/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.44 |
| ▸ | JAK2 | O60674 | 2/20 | 0.40 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.40 |
| ▸ | CDK9 | P50750 | 2/20 | 0.40 |
| ▸ | PLK4 | O00444 | 1/20 | 0.40 |
| ▸ | STK10 | O94804 | 1/20 | 0.40 |
| ▸ | ABL1 | P00519 | 1/20 | 0.40 |
| ▸ | PRKCB | P05771 | 1/20 | 0.40 |
| ▸ | MET | P08581 | 1/20 | 0.40 |
| ▸ | TOP2A | P11388 | 1/20 | 0.40 |
| ▸ | PRKCA | P17252 | 1/20 | 0.40 |
| ▸ | CSNK2A2 | P19784 | 1/20 | 0.40 |
| ▸ | JAK1 | P23458 | 1/20 | 0.40 |
| ▸ | MARK3 | P27448 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL14465240 | 0.90 | ALDH1A1 (0.40) | CYP1A2CYP3A4ALDH1A1CLK4HSD17B10 | |
| SCHEMBL14465256 | 0.83 | ALDH1A1 (0.40) | CYP1A2CYP3A4ALDH1A1CLK4HSD17B10 | |
| SCHEMBL14327614 | 0.81 | CLK4 (0.46) | CYP1A2CYP3A4ALDH1A1CLK4MAPK1 | |
| SCHEMBL14712339 | 0.81 | JAK2 (0.49) | CYP1A2CYP3A4ALDH1A1CLK4MAPK1 | |
| SCHEMBL24059738 | 0.78 | CYP1A2 (0.38) | CYP1A2CYP3A4ALDH1A1CLK4MAPK1 | |
| SCHEMBL2630217 | 0.77 | JAK3 (0.48) | CLK4JAK2ROCK2CDK9PLK4 | |
| SCHEMBL2630148 | 0.77 | JAK3 (0.49) | CYP3A4JAK2ROCK2CDK9PLK4 | |
| SCHEMBL15723264 | 0.76 | CCNT1 (0.42) | CDK9JAK3 | |
| SCHEMBL10303502 | 0.76 | CCNT1 (0.42) | CDK9JAK3 | |
| SCHEMBL2633664 | 0.76 | JAK2 (0.52) | CYP1A2CYP3A4ALDH1A1JAK2CDK9 |
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-2007084557-A2 | AZAINDOLES USEFUL AS INHIBITORS OF JANUS KINASES | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2007-07-26 | — | — | WO | disclosed |