Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.51 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.51 |
| ▸ | GABRA1 | P14867 | 3/20 | 0.49 |
| ▸ | GABRG2 | P18507 | 3/20 | 0.49 |
| ▸ | GABRB3 | P28472 | 3/20 | 0.49 |
| ▸ | GABRA3 | P34903 | 3/20 | 0.49 |
| ▸ | GABRA2 | P47869 | 3/20 | 0.49 |
| ▸ | ACP1 | P24666 | 3/20 | 0.44 |
| ▸ | ACHE | P22303 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | PIM1 | P11309 | 2/20 | 0.39 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.39 |
| ▸ | DRD2 | P14416 | 1/20 | 0.39 |
| ▸ | DRD3 | P35462 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL6995504 | 0.93 | MAPK1 (0.48) | HSD17B10MAPK1GABRA1GABRG2GABRB3 | |
| SCHEMBL6998406 | 0.87 | GABRA1 (0.47) | HSD17B10MAPK1GABRA1GABRG2GABRB3 | |
| SCHEMBL6999403 | 0.87 | LMNA (0.51) | GABRA1GABRG2GABRB3GABRA3GABRA2 | |
| SCHEMBL6990520 | 0.85 | ADORA1 (0.47) | HSD17B10MAPK1GABRA1GABRG2GABRB3 | |
| SCHEMBL6997245 | 0.84 | GABRA1 (0.49) | HSD17B10MAPK1GABRA1GABRG2GABRB3 | |
| SCHEMBL6995960 | 0.84 | SOD1 (0.47) | HSD17B10MAPK1GABRA1GABRG2GABRB3 | |
| SCHEMBL6995913 | 0.82 | GABRA1 (0.52) | HSD17B10GABRA1GABRG2GABRB3GABRA3 | |
| SCHEMBL6991737 | 0.82 | GABRA1 (0.50) | HSD17B10GABRA1GABRG2GABRB3GABRA3 | |
| SCHEMBL7000505 | 0.82 | GABRA1 (0.49) | HSD17B10MAPK1GABRA1GABRG2GABRB3 | |
| SCHEMBL6993668 | 0.80 | HSD17B10 (0.50) | HSD17B10MAPK1GABRA1GABRG2GABRB3 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1049697-B1 | TRIAZOLO-PYRIDAZINE DERIVATIVES AS LIGANDS FOR GABA RECEPTORS | MERCK SHARP & DOHME (GB) | 2003-09-17 | — | — | EP | claimed |
| EP-1049697-B1 | TRIAZOLO-PYRIDAZINE DERIVATIVES AS LIGANDS FOR GABA RECEPTORS | MERCK SHARP & DOHME (GB) | 2003-09-17 | — | — | EP | disclosed |
| US-6355798-B1 | LIGANDS FOR GAMMA-AMINOBUTYRIC ACID RECEPTORS; ANTICONVULSANTS, ANXIOLYTIC AGENTS | MERCK SHARP & DOHME LTD. (GB) | 2002-03-12 | — | — | US | disclosed |