Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 2/20 | 0.44 |
| ▸ | ALOX5AP | P20292 | 2/20 | 0.42 |
| ▸ | FEN1 | P39748 | 2/20 | 0.42 |
| ▸ | ELANE | P08246 | 1/20 | 0.38 |
| ▸ | PRTN3 | P24158 | 1/20 | 0.38 |
| ▸ | CA12 | O43570 | 6/20 | 0.37 |
| ▸ | CA9 | Q16790 | 6/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | THRB | P10828 | 1/20 | 0.36 |
| ▸ | BLM | P54132 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | NEK1 | Q96PY6 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL8993438 | 0.80 | CA12 (0.44) | CYP2C19ALOX5APFEN1CA12CA9 | |
| SCHEMBL15915560 | 0.78 | RECQL (0.55) | CYP2C19ALOX5APFEN1CA12CA9 | |
| SCHEMBL20267870 | 0.78 | GBA1 (0.54) | CYP2C19ALOX5APFEN1MEN1KMT2A | |
| SCHEMBL2801003 | 0.76 | ALDH1A1 (0.44) | CYP2C19ALOX5APFEN1CYP2C9MEN1 | |
| SCHEMBL2801005 | 0.75 | NSD2 (0.47) | CYP2C19ALOX5APFEN1ELANEPRTN3 | |
| SCHEMBL11890046 | 0.75 | CYP2C19 (0.73) | CYP2C19CA12CA9LMNAALDH1A1 | |
| SCHEMBL2798389 | 0.74 | LMNA (0.46) | CYP2C19ELANEPRTN3CYP2C9MEN1 | |
| SCHEMBL7184559 | 0.74 | CA1 (0.52) | CYP2C19ELANEPRTN3CYP2C9MEN1 | |
| SCHEMBL2799637 | 0.74 | CA12 (0.58) | CA12CA9LMNAKMT2AALDH1A1 | |
| SCHEMBL14398993 | 0.74 | PKLR (0.49) | CA12CA9LMNATHRBALDH1A1 |
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-2148862-A1 | DIHYDROQUINONE AND DIHYDRONAPHTHRIDINE INHIBITORS OF JNK | F. Hoffmann-Roche AG (CH) | 2010-02-03 | — | — | EP | disclosed |
| WO-2008138920-A1 | DIHYDROQUINONE AND DIHYDRONAPHTHRIDINE INHIBITORS OF JNK | F. HOFFMANN-LA ROCHE AG (CH) | 2008-11-20 | — | — | WO | disclosed |