Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.37 |
| ▸ | POLB | P06746 | 2/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.37 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.36 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.36 |
| ▸ | CASP3 | P42574 | 1/20 | 0.35 |
| ▸ | TLR2 | O60603 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 4/20 | 0.34 |
| ▸ | DUSP3 | P51452 | 1/20 | 0.34 |
| ▸ | PTPN5 | P54829 | 1/20 | 0.34 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL4620598 | 0.85 | HCAR2 (0.37) | MEN1KMT2AALDH1A1KDM4EHSD17B10 | |
| SCHEMBL28692905 | 0.83 | HCAR2 (0.36) | MEN1KMT2AALDH1A1KDM4EHSD17B10 | |
| Calcium SCHEMBL30537018 | 0.83 | HCAR2 (0.36) | MEN1KMT2AALDH1A1KDM4EHSD17B10 | |
| SCHEMBL7950766 | 0.80 | KDM4E (0.46) | MEN1KMT2AALDH1A1KDM4EHSD17B10 | |
| SCHEMBL4548482 | 0.80 | ALDH1A1 (0.39) | MEN1KMT2AALDH1A1KDM4EHSD17B10 | |
| SCHEMBL4548465 | 0.80 | ALDH1A1 (0.39) | MEN1KMT2AALDH1A1KDM4EHSD17B10 | |
| SCHEMBL8680389 | 0.80 | HCAR2 (0.34) | MEN1KMT2AALDH1A1KDM4EHSD17B10 | |
| SCHEMBL734433 | 0.79 | HCAR2 (0.35) | KMT2AALDH1A1KDM4EHSD17B10ALOX15 | |
| SCHEMBL7950768 | 0.79 | ALDH1A1 (0.39) | MEN1KMT2AALDH1A1KDM4EHSD17B10 | |
| SCHEMBL5607802 | 0.76 | SLC6A3 (0.44) | ALDH1A1KDM4ESLC6A3SLC6A2SLC6A4 |
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-0915875-A2 | SUBSTITUTED TRIAZOLO-PYRIDAZINE DERIVATIVES AS LIGANDS FOR GABA RECEPTORS | MERCK SHARP & DOHME LTD. (GB) | 1999-05-19 | — | — | EP | disclosed |
| WO-1998004559-A2 | SUBSTITUTED TRIAZOLO-PYRIDAZINE DERIVATIVES AS LIGANDS FOR GABA RECEPTORS | MERCK SHARP & DOHME LIMITED (GB) | 1998-02-05 | — | — | WO | disclosed |