Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IMPDH2 | P12268 | 2/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | GAA | P10253 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL9952954 | 0.74 | IMPDH2 (0.35) | IMPDH2KDM4EALDH1A1GAA | |
| SCHEMBL9929001 | 0.71 | IMPDH2 (0.32) | IMPDH2 | |
| SCHEMBL9952752 | 0.71 | IMPDH2 (0.35) | IMPDH2KDM4EALDH1A1GAA | |
| Hydrochloric Acid SCHEMBL9929406 | 0.71 | LMNA (0.33) | CYP1A2LMNAALDH1A1 | |
| SCHEMBL19156364 | 0.70 | LMNA (0.31) | LMNA | |
| SCHEMBL1820622 | 0.68 | CYP1A2 (0.44) | CYP1A2KDM4ELMNASMN1; SMN2 | |
| SCHEMBL14736536 | 0.67 | IMPDH2 (0.39) | IMPDH2KDM4EALDH1A1GAA | |
| Hydrochloric Acid SCHEMBL9953044 | 0.65 | TAAR1 (0.42) | IMPDH2CYP1A2 | |
| SCHEMBL14742448 | 0.64 | IMPDH2 (0.45) | IMPDH2CYP1A2KDM4EALDH1A1GAA | |
| SCHEMBL9952754 | 0.63 | IMPDH2 (0.42) | IMPDH2CYP1A2KDM4ELMNAALDH1A1 |
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-2655374-A1 | N-(1-(SUBSTITUTED-PHENYL)ETHYL)-9H-PURIN-6-AMINES AS PI3K INHIBITORS | Incyte Corporation (US) | 2013-10-30 | — | — | EP | disclosed |
| WO-2012087881-A1 | N-(1-(SUBSTITUTED-PHENYL)ETHYL)-9H-PURIN-6-AMINES AS PI3K INHIBITORS | INCYTE CORPORATION (US) | 2012-06-28 | — | — | WO | disclosed |