Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.67 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.67 |
| ▸ | BRD4 | O60885 | 1/20 | 0.67 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.67 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.67 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.67 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.67 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.67 |
| ▸ | HPGD | P15428 | 1/20 | 0.61 |
| ▸ | PIM1 | P11309 | 4/20 | 0.55 |
| ▸ | MET | P08581 | 3/20 | 0.52 |
| ▸ | LMNA | P02545 | 1/20 | 0.52 |
| ▸ | MAPT | P10636 | 1/20 | 0.52 |
| ▸ | HTT | P42858 | 1/20 | 0.52 |
| ▸ | LRRK2 | Q5S007 | 3/20 | 0.52 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.50 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.50 |
| ▸ | POLB | P06746 | 1/20 | 0.50 |
| ▸ | MARK3 | P27448 | 1/20 | 0.50 |
| ▸ | GSK3B | P49841 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL11489169 | 0.84 | KDM4E (0.65) | KDM4EHSD17B10BRD4HPGDLMNA | |
| SCHEMBL10806414 | 0.80 | KDM4E (0.65) | KDM4EHSD17B10BRD4ADORA3ADORA2A | |
| SCHEMBL4506913 | 0.80 | KDM4E (0.65) | KDM4EHSD17B10BRD4ADORA3ADORA2A | |
| SCHEMBL4784567 | 0.80 | BRD4 (0.65) | KDM4EHSD17B10BRD4ADORA3ADORA2A | |
| SCHEMBL11116760 | 0.80 | KDM4E (0.65) | KDM4EHSD17B10BRD4ADORA3ADORA2A | |
| SCHEMBL863630 | 0.79 | NPC1 (0.52) | KDM4EHSD17B10BRD4ADORA3ADORA2A | |
| Hydrochloric Acid SCHEMBL11199042 | 0.79 | KDM4E (0.63) | KDM4EHSD17B10BRD4ADORA3ADORA2A | |
| SCHEMBL937186 | 0.77 | KDM4E (0.45) | KDM4EHSD17B10BRD4ADORA3ADORA2A | |
| SCHEMBL2302764 | 0.76 | KDM4E (1.00) | KDM4EHSD17B10BRD4ADORA3ADORA2A | |
| SCHEMBL11388088 | 0.76 | KDM4E (0.64) | KDM4EHSD17B10MET |
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 4 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 | claimed |
| WO-1998004559-A2 | SUBSTITUTED TRIAZOLO-PYRIDAZINE DERIVATIVES AS LIGANDS FOR GABA RECEPTORS | MERCK SHARP & DOHME LIMITED (GB) | 1998-02-05 | — | — | WO | claimed |
| 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 |