Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 1/20 | 0.68 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.56 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.56 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.56 |
| ▸ | RAB9A | P51151 | 6/20 | 0.53 |
| ▸ | NPC1 | O15118 | 5/20 | 0.53 |
| ▸ | HPGD | P15428 | 4/20 | 0.53 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.53 |
| ▸ | GAA | P10253 | 1/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | TSHR | P16473 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | CASP1 | P29466 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.44 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.44 |
| ▸ | STAT1 | P42224 | 1/20 | 0.44 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.44 |
| ▸ | RELA | Q04206 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL27723934 | 0.87 | SMN1; SMN2 (0.55) | BRD4SMN1; SMN2CYP1A2CYP2C19RAB9A | |
| SCHEMBL29922633 | 0.81 | BRD4 (0.79) | BRD4SMN1; SMN2RAB9ANPC1HPGD | |
| SCHEMBL21830986 | 0.81 | BRD4 (0.79) | BRD4SMN1; SMN2RAB9ANPC1HPGD | |
| SCHEMBL4906896 | 0.81 | BRD4 (0.70) | BRD4SMN1; SMN2CYP1A2CYP2C19RAB9A | |
| SCHEMBL30910867 | 0.80 | BRD4 (0.86) | BRD4SMN1; SMN2CYP1A2CYP2C19RAB9A | |
| SCHEMBL3135286 | 0.79 | SMN1; SMN2 (0.82) | SMN1; SMN2CYP1A2CYP2C19RAB9ANPC1 | |
| SCHEMBL8203991 | 0.79 | SMN1; SMN2 (0.57) | SMN1; SMN2CYP1A2CYP2C19RAB9ANPC1 | |
| SCHEMBL8192523 | 0.79 | SMN1; SMN2 (0.54) | SMN1; SMN2CYP1A2CYP2C19RAB9ANPC1 | |
| SCHEMBL5572207 | 0.79 | SMN1; SMN2 (0.54) | SMN1; SMN2CYP1A2CYP2C19RAB9ANPC1 | |
| SCHEMBL14214178 | 0.78 | MEN1 (0.59) | SMN1; SMN2CYP1A2CYP2C19RAB9AGAA |
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-2132178-A2 | NOVEL JNK INHIBITORS | SCHERING CORPORATION (US) | 2009-12-16 | — | — | EP | disclosed |
| WO-2008082487-A2 | NOVEL JNK INHIBITORS | SCHERING CORPORATION (US) | 2008-07-10 | — | — | WO | disclosed |