Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DAO | P14920 | 1/20 | 0.55 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | TP53 | P04637 | 2/20 | 0.35 |
| ▸ | GSK3B | P49841 | 3/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | CASP3 | P42574 | 2/20 | 0.35 |
| ▸ | SENP8 | Q96LD8 | 2/20 | 0.35 |
| ▸ | SENP7 | Q9BQF6 | 2/20 | 0.35 |
| ▸ | SENP6 | Q9GZR1 | 2/20 | 0.35 |
| ▸ | KDM5A | P29375 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL7492494 | 0.86 | DAO (0.52) | DAONPSR1MAPTHSD17B10LMNA | |
| SCHEMBL195427 | 0.82 | DAO (0.61) | DAONPSR1MAPTTP53GSK3B | |
| SCHEMBL14625551 | 0.80 | DAO (0.46) | DAONPSR1HTTMAPTTP53 | |
| SCHEMBL10352205 | 0.80 | DAO (0.50) | DAONPSR1HTTMEN1LMNA | |
| SCHEMBL10351531 | 0.79 | DAO (0.57) | DAONPSR1MAPTTP53GSK3B | |
| Hydrochloric Acid SCHEMBL10352524 | 0.79 | DAO (0.49) | DAONPSR1HTTMEN1LMNA | |
| SCHEMBL9590792 | 0.79 | DAO (0.61) | DAONPSR1MAPTTP53GSK3B | |
| SCHEMBL11458003 | 0.77 | DAO (0.59) | DAONPSR1MAPTTP53GSK3B | |
| SCHEMBL3752532 | 0.75 | DAO (0.61) | DAONPSR1HTTMAPTTP53 | |
| SCHEMBL7368425 | 0.73 | DAO (0.71) | DAONPSR1MAPTTP53GSK3B |
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 |
|---|---|---|---|---|---|---|---|
| US-6169188-B1 | TREATING CYCLOOXYGENASE-2 MEDIATED DISEASES | MERCK FROSST CANADA & CO. (CA) | 2001-01-02 | — | — | US | disclosed |
| US-5981576-A | (Methylsulfonyl)phenyl-2-(5H)-furanones as COX-2 inhibitors | MERCK FROSST CANADA, INC. (CA) | 1999-11-09 | — | — | US | disclosed |