Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IMPDH2 | P12268 | 5/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | GAA | P10253 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.34 |
| ▸ | TPMT | P51580 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.33 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.33 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL9952087 | 0.78 | IMPDH2 (0.38) | IMPDH2CYP3A4ALDH1A1KDM4EGAA | |
| SCHEMBL9952629 | 0.78 | IMPDH2 (0.47) | IMPDH2ALDH1A1KDM4EGAAHSP90AA1 | |
| SCHEMBL9952473 | 0.77 | IMPDH2 (0.41) | IMPDH2CYP3A4ALDH1A1KDM4EGAA | |
| SCHEMBL10863911 | 0.76 | CYP3A4 (0.46) | IMPDH2CYP3A4ALDH1A1KDM4EGAA | |
| SCHEMBL14742274 | 0.76 | IMPDH2 (0.36) | IMPDH2 | |
| SCHEMBL9929296 | 0.76 | HSD17B10 (0.40) | IMPDH2CYP3A4ALDH1A1KDM4EGAA | |
| SCHEMBL9952278 | 0.76 | ALDH1A1 (0.38) | IMPDH2ALDH1A1KDM4EGAAMAPT | |
| SCHEMBL9952029 | 0.75 | TAAR1 (0.46) | IMPDH2 | |
| SCHEMBL9952084 | 0.74 | LMNA (0.38) | IMPDH2ALDH1A1KDM4EGAAHSP90AA1 | |
| Hydrochloric Acid SCHEMBL9952054 | 0.74 | TAAR1 (0.45) | IMPDH2 |
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 |