Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 1/20 | 0.40 |
| ▸ | DAO | P14920 | 3/20 | 0.37 |
| ▸ | KAT8 | Q9H7Z6 | 1/20 | 0.34 |
| ▸ | IDH1 | O75874 | 1/20 | 0.33 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.33 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | ACHE | P22303 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL28173296 | 0.85 | DAO (0.53) | DAOACHE | |
| SCHEMBL23528212 | 0.82 | DAO (0.44) | MAOADAOKDM4E | |
| SCHEMBL79201 | 0.75 | MAOA (0.47) | MAOADAOKAT8 | |
| SCHEMBL1108477 | 0.74 | TAAR1 (0.50) | MAOADAO | |
| SCHEMBL1856737 | 0.73 | TP53 (0.41) | MAOA | |
| SCHEMBL27533766 | 0.73 | CYP3A4 (0.52) | MAOACYP11B1CYP11B2 | |
| SCHEMBL10516151 | 0.73 | MAOB (0.46) | MAOACYP11B1CYP11B2 | |
| SCHEMBL25566540 | 0.73 | MAOA (0.35) | MAOAKAT8 | |
| SCHEMBL6284681 | 0.73 | MAOA (0.45) | MAOADAOKAT8 | |
| Bromide SCHEMBL29027396 | 0.73 | MAOA (0.45) | MAOADAOKAT8 |
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 |
|---|---|---|---|---|---|---|---|
| US-6255490-B1 | TREATING DISORDERS ASSOCIATED WITH CHANGES IN CHOLINERGIC ACTIVITY; NON-OPIATE BASED ANALGESIC FOR MODERATE TO SEVERE PAIN EQUALLY OR EXCEEDING THE POTENCY OF OPIATE ANALGESICS, YET LACKING ADDICTIVE SIDE EFFECTS | UNIVERSITY OF VIRGINIA | 2001-07-03 | — | — | US | disclosed |
| US-6060473-A | 7-azabicyclo[2.2.1]-heptane and -heptene derivatives as cholinergic receptor ligands | UCB S.A. - DTB (BE) | 2000-05-09 | — | — | US | disclosed |
| US-5817679-A | ANALGESICS, ANTIINFLAMMATORY AGENTS | UNIVERSITY OF VIRGINIA (US) | 1998-10-06 | — | — | US | disclosed |