Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PANK3 | Q9H999 | 1/20 | 0.44 |
| ▸ | IRAK4 | Q9NWZ3 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | PPARG | P37231 | 1/20 | 0.40 |
| ▸ | PPARA | Q07869 | 1/20 | 0.40 |
| ▸ | PARP1 | P09874 | 1/20 | 0.40 |
| ▸ | DHFR | P00374 | 1/20 | 0.39 |
| ▸ | SMO | Q99835 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 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 | |
|---|---|---|---|---|
| SCHEMBL12697956 | 0.85 | MAP4K4 (0.50) | HRH3LMNA | |
| SCHEMBL5237033 | 0.83 | PANK3 (0.57) | PANK3MEN1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL17818499 | 0.82 | SLC6A9 (0.38) | IRAK4PPARGPPARA | |
| SCHEMBL16371441 | 0.74 | DGAT1 (0.43) | IRAK4DHFR | |
| SCHEMBL16371439 | 0.74 | IRAK4 (0.36) | PANK3IRAK4HRH3DHFR | |
| SCHEMBL14269363 | 0.74 | PANK3 (0.56) | PANK3MEN1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL27723056 | 0.73 | PANK3 (0.59) | PANK3MEN1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL2456399 | 0.72 | ME2 (0.47) | MEN1CYP1A2CYP2C9CYP2C19KMT2A | |
| SCHEMBL1630859 | 0.72 | L3MBTL1 (0.58) | PANK3MEN1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL16178191 | 0.71 | SMO (0.43) | MEN1CYP1A2CYP2C9CYP2C19KMT2A |
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-3019171-A1 | SUBSTITUTED AMIDOPYRAZOLE INHIBITORS OF INTERLEUKIN RECEPTOR-ASSOCIATED KINASES (IRAK-4) | Merck Sharp & Dohme Corp. (US) | 2016-05-18 | — | — | EP | disclosed |
| WO-2015006181-A1 | SUBSTITUTED AMIDOPYRAZOLE INHIBITORS OF INTERLEUKIN RECEPTOR-ASSOCIATED KINASES (IRAK-4) | MERCK SHARP & DOHME CORP. (US) | 2015-01-15 | — | — | WO | disclosed |