Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B1 | P15538 | 5/20 | 0.38 |
| ▸ | CYP11B2 | P19099 | 5/20 | 0.38 |
| ▸ | CYP17A1 | P05093 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.36 |
| ▸ | PRMT5 | O14744 | 1/20 | 0.34 |
| ▸ | WDR77 | Q9BQA1 | 1/20 | 0.34 |
| ▸ | TLR7 | Q9NYK1 | 2/20 | 0.34 |
| ▸ | HPRT1 | P00492 | 1/20 | 0.33 |
| ▸ | PRKCZ | Q05513 | 1/20 | 0.33 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.32 |
| ▸ | MPO | P05164 | 1/20 | 0.32 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.32 |
| ▸ | NQO2 | P16083 | 1/20 | 0.32 |
| ▸ | ADORA2B | P29275 | 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 | |
|---|---|---|---|---|
| SCHEMBL2717827 | 0.85 | TAAR1 (0.41) | CYP3A4TAAR1HPRT1MPOSLC6A4 | |
| SCHEMBL2013334 | 0.82 | TAAR1 (0.48) | TAAR1HPRT1MPOSLC6A4 | |
| SCHEMBL2013343 | 0.81 | KDM4E (0.36) | CYP3A4TLR7PDE10ANQO2ADORA2B | |
| SCHEMBL2053387 | 0.74 | MAPK1 (0.44) | CYP3A4TAAR1 | |
| SCHEMBL2015661 | 0.74 | CYP11B1 (0.38) | CYP11B1CYP11B2CYP17A1CYP3A4TLR7 | |
| SCHEMBL2051915 | 0.73 | NUDT1 (0.38) | CYP3A4 | |
| Hydrochloric Acid SCHEMBL20564378 | 0.69 | TAAR1 (0.48) | CYP3A4TAAR1HPRT1MPOSLC6A4 | |
| SCHEMBL2015807 | 0.68 | MAPK14 (0.36) | CYP11B1CYP11B2CYP17A1CYP3A4TLR7 | |
| SCHEMBL20563318 | 0.67 | TAAR1 (0.50) | CYP3A4TAAR1MPOSLC6A4 | |
| SCHEMBL29263807 | 0.67 | PRKCZ (0.47) | CYP11B1CYP11B2CYP3A4TAAR1PRKCZ |
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-2011075630-A1 | SUBSTITUTED FUSED ARYL AND HETEROARYL DERIVATIVES AS PI3K INHIBITORS | INCYTE CORPORATION (US) | 2011-06-23 | — | — | WO | disclosed |