Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 4/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.50 |
| ▸ | HTT | P42858 | 2/20 | 0.50 |
| ▸ | TSHR | P16473 | 2/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | LPL | P06858 | 5/20 | 0.36 |
| ▸ | LIPG | Q9Y5X9 | 5/20 | 0.36 |
| ▸ | CA12 | O43570 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | RECQL | P46063 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL1164818 | 0.84 | ALDH1A1 (0.45) | KMT2ASMN1; SMN2HTTTSHRMEN1 | |
| SCHEMBL1164490 | 0.84 | KMT2A (0.48) | KMT2ASMN1; SMN2HTTTSHRMEN1 | |
| SCHEMBL12846047 | 0.81 | MAPK1 (0.42) | KMT2ASMN1; SMN2HTTTSHRMEN1 | |
| SCHEMBL1164297 | 0.79 | CA1 (0.38) | SMN1; SMN2LPLLIPGCA12CA9 | |
| SCHEMBL16004583 | 0.79 | ALDH1A1 (0.33) | KMT2ASMN1; SMN2HTTTSHRMEN1 | |
| SCHEMBL1164423 | 0.79 | SMN1; SMN2 (0.34) | KMT2ASMN1; SMN2HTTTSHRMEN1 | |
| SCHEMBL1163931 | 0.79 | CA1 (0.35) | KMT2ASMN1; SMN2HTTMEN1ALDH1A1 | |
| SCHEMBL1164320 | 0.74 | LOX (0.39) | LPLLIPGCA12CA9 | |
| SCHEMBL11051510 | 0.73 | KMT2A (0.61) | KMT2ASMN1; SMN2HTTTSHRMEN1 | |
| SCHEMBL2288390 | 0.73 | CA12 (0.51) | KMT2ASMN1; SMN2HTTTSHRMEN1 |
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-2001849-A1 | PYRIDINE AND PYRIMIDINE DERIVATIVES AS MGLUR2 ANTAGONISTS | F. Hoffmann-Roche AG (CH) | 2008-12-17 | — | — | EP | disclosed |
| WO-2007110337-A1 | PYRIDINE AND PYRIMIDINE DERIVATIVES AS MGLUR2 ANTAGONISTS | F. HOFFMANN-LA ROCHE AG (CH) | 2007-10-04 | — | — | WO | disclosed |