Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.37 |
| ▸ | GRIA1 | P42261 | 1/20 | 0.35 |
| ▸ | GRIA2 | P42262 | 1/20 | 0.35 |
| ▸ | GRIA3 | P42263 | 1/20 | 0.35 |
| ▸ | GRIA4 | P48058 | 1/20 | 0.35 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.34 |
| ▸ | CNR2 | P34972 | 3/20 | 0.33 |
| ▸ | DRD2 | P14416 | 3/20 | 0.33 |
| ▸ | DRD3 | P35462 | 3/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.33 |
| ▸ | CNR1 | P21554 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.33 |
| ▸ | CA12 | O43570 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | CA4 | P22748 | 1/20 | 0.33 |
| ▸ | CA6 | P23280 | 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 | |
|---|---|---|---|---|
| SCHEMBL15763339 | 0.80 | PARK7 (0.37) | ALDH1A1L3MBTL1GRIA1GRIA2GRIA3 | |
| SCHEMBL4542848 | 0.72 | SMN1; SMN2 (0.46) | CNR2 | |
| SCHEMBL15765542 | 0.72 | SMN1; SMN2 (0.46) | CNR2 | |
| SCHEMBL15765559 | 0.72 | HTR2C (0.39) | ALDH1A1GRIA1GRIA2GRIA3GRIA4 | |
| SCHEMBL7032455 | 0.72 | HTR2C (0.39) | ALDH1A1GRIA1GRIA2GRIA3GRIA4 | |
| SCHEMBL15763334 | 0.72 | HTR2C (0.39) | ALDH1A1GRIA1GRIA2GRIA3GRIA4 | |
| SCHEMBL15765525 | 0.72 | HTR2C (0.39) | ALDH1A1GRIA1GRIA2GRIA3GRIA4 | |
| Hydrochloric Acid SCHEMBL15754387 | 0.71 | HTR2C (0.38) | ALDH1A1GRIA1GRIA2GRIA3GRIA4 | |
| SCHEMBL14922291 | 0.70 | KDM4E (0.46) | ALDH1A1L3MBTL1 | |
| SCHEMBL18488822 | 0.68 | HTR2C (0.62) | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2661435-B1 | 1,2,4-TRIAZOLO[4,3-a]PYRIDINE DERIVATIVES AND THEIR USE AS POSITIVE ALLOSTERIC MODULATORS OF MGLUR2 RECEPTORS | JANSSEN PHARMACEUTICALS INC (US) | 2015-08-19 | — | — | EP | disclosed |