Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.36 |
| ▸ | WNT3A | P56704 | 1/20 | 0.36 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.36 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.36 |
| ▸ | ADRA1D | P25100 | 2/20 | 0.36 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.36 |
| ▸ | ADRA1B | P35368 | 2/20 | 0.36 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.35 |
| ▸ | USP2 | O75604 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | ITGB2 | P05107 | 1/20 | 0.33 |
| ▸ | ICAM1 | P05362 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL10430779 | 0.85 | POLB (0.43) | HTT | |
| SCHEMBL15988656 | 0.77 | SMN1; SMN2 (0.41) | SMN1; SMN2ALDH1A1KDM4EHPGDHTT | |
| SCHEMBL13902883 | 0.75 | ADRA2A (0.46) | SMN1; SMN2ALDH1A1KDM4EHSD17B10HPGD | |
| SCHEMBL12446380 | 0.75 | ALDH1A1 (0.40) | SMN1; SMN2ALDH1A1KDM4EHSD17B10HPGD | |
| SCHEMBL14405280 | 0.74 | HTR2C (0.37) | SMN1; SMN2ADRA2AADRA2CADRA1A | |
| SCHEMBL4714664 | 0.74 | KDM4E (0.58) | SMN1; SMN2ALDH1A1KDM4EHSD17B10HPGD | |
| SCHEMBL14382047 | 0.73 | CYP2A6 (0.38) | KDM4ECTNNB1WNT3AADRA1DADRA1A | |
| SCHEMBL19346092 | 0.73 | SMN1; SMN2 (0.42) | SMN1; SMN2ALDH1A1KDM4EHPGDHTT | |
| SCHEMBL15988786 | 0.73 | KDM4E (0.55) | SMN1; SMN2ALDH1A1KDM4EHSD17B10CTNNB1 | |
| SCHEMBL30200165 | 0.73 | KDM4E (0.55) | SMN1; SMN2ALDH1A1KDM4EHSD17B10CTNNB1 |
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-1373257-B9 | INHIBITORS OF C-JUN N-TERMINAL KINASES (JNK) AND OTHER PROTEIN KINASES | VERTEX PHARMA (US) | 2008-10-15 | — | — | EP | disclosed |
| EP-1373257-B1 | INHIBITORS OF C-JUN N-TERMINAL KINASES (JNK) AND OTHER PROTEIN KINASES | VERTEX PHARMA (US) | 2007-11-28 | — | — | EP | disclosed |