Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NUDT1 | P36639 | 2/20 | 0.48 |
| ▸ | CIT | O14578 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | PRKCI | P41743 | 3/20 | 0.40 |
| ▸ | AXL | P30530 | 1/20 | 0.40 |
| ▸ | IKBKB | O14920 | 1/20 | 0.39 |
| ▸ | CHUK | O15111 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | BRD4 | O60885 | 1/20 | 0.39 |
| ▸ | NEK1 | Q96PY6 | 2/20 | 0.38 |
| ▸ | JAK3 | P52333 | 2/20 | 0.38 |
| ▸ | JAK2 | O60674 | 2/20 | 0.38 |
| ▸ | JAK1 | P23458 | 2/20 | 0.38 |
| ▸ | TYK2 | P29597 | 2/20 | 0.38 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.38 |
| ▸ | MET | P08581 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL2878621 | 0.85 | PARP1 (0.47) | NUDT1CITPRKCIAXLIKBKB | |
| SCHEMBL14416608 | 0.83 | NUDT1 (0.52) | NUDT1CITPRKCIAXLIKBKB | |
| SCHEMBL2876216 | 0.80 | NUDT1 (0.60) | NUDT1CITALDH1A1MAPTHPGD | |
| SCHEMBL12605518 | 0.79 | PARP1 (0.56) | NUDT1CITPRKCIAXLIKBKB | |
| SCHEMBL19648515 | 0.78 | PRKCI (0.47) | NUDT1CITPRKCIAXLIKBKB | |
| SCHEMBL12605516 | 0.78 | NUDT1 (0.47) | NUDT1CITPRKCIAXLIKBKB | |
| SCHEMBL7378944 | 0.77 | ALDH1A1 (0.46) | ALDH1A1MAPTHPGDSMN1; SMN2CYP1A2 | |
| SCHEMBL22367598 | 0.77 | CYP1A2 (0.52) | ALDH1A1MAPTHPGDSMN1; SMN2CYP1A2 | |
| SCHEMBL22493827 | 0.75 | NUDT1 (0.47) | NUDT1CITPRKCIAXLIKBKB | |
| SCHEMBL13069320 | 0.75 | PRKCI (0.50) | NUDT1CITPRKCIAXLIKBKB |
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-2002836-B1 | Cyclocondensed azaindoles active as kinase inhibitors | NERVIANO MEDICAL SCIENCES SRL (IT) | 2010-10-20 | — | — | EP | disclosed |
| EP-2002836-A1 | Cyclocondensed azaindoles active as kinase inhibitors | Nerviano Medical Sciences S.r.l. (IT) | 2008-12-17 | — | — | EP | disclosed |