Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS1 | P23219 | 3/20 | 0.58 |
| ▸ | NQO2 | P16083 | 1/20 | 0.58 |
| ▸ | NFE2L2 | Q16236 | 10/20 | 0.53 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.51 |
| ▸ | RELA | Q04206 | 2/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | APP | P05067 | 3/20 | 0.45 |
| ▸ | GLO1 | Q04760 | 1/20 | 0.43 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | GFER | P55789 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL4714571 | 1.00 | PTGS1 (0.58) | PTGS1NQO2NFE2L2PTGS2RELA | |
| SCHEMBL27497604 | 0.84 | PTGS1 (0.47) | PTGS1NQO2NFE2L2PTGS2RELA | |
| SCHEMBL4711845 | 0.82 | CHAT (0.45) | RELAKDM4EALDH1A1HPGDSMN1; SMN2 | |
| SCHEMBL4711844 | 0.82 | CHAT (0.45) | RELAKDM4EALDH1A1HPGDSMN1; SMN2 | |
| SCHEMBL27497603 | 0.81 | PTGS1 (0.48) | PTGS1NQO2NFE2L2PTGS2RELA | |
| SCHEMBL4712775 | 0.81 | GRM4 (0.51) | PTGS1PTGS2KDM4ENPC1ALDH1A1 | |
| SCHEMBL4710346 | 0.81 | GRM4 (0.51) | PTGS1PTGS2KDM4ENPC1ALDH1A1 | |
| SCHEMBL4710348 | 0.81 | GRM4 (0.51) | PTGS1PTGS2KDM4ENPC1ALDH1A1 | |
| SCHEMBL4714568 | 0.76 | NFE2L2 (0.44) | PTGS1NQO2NFE2L2PTGS2RELA | |
| SCHEMBL4714566 | 0.76 | NFE2L2 (0.44) | PTGS1NQO2NFE2L2PTGS2RELA |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0998459-B1 | PYRIDINE DERIVATIVES | NOVARTIS AG (CH) | 2008-04-23 | — | — | EP | claimed |
| EP-0998459-A2 | PYRIDINE DERIVATIVES | Novartis AG (CH) | 2000-05-10 | — | — | EP | claimed |
| WO-1999002497-A2 | PYRIDINE DERIVATIVES | NOVARTIS AG (CH) | 1999-01-21 | — | — | WO | claimed |
| EP-0998459-B1 | PYRIDINE DERIVATIVES | NOVARTIS AG (CH) | 2008-04-23 | — | — | EP | disclosed |
| US-6656957-B1 | Marked and selective modulating, especially antagonistic, action at human metabotropic glutamate receptors (mGluRs); treatment of disorders such as epilepsy, cerebral ischemias, especially acute ischemias, spasticity etc. | NOVARTIS AG (CH) | 2003-12-02 | — | — | US | disclosed |