Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.36 |
| ▸ | HDAC4 | P56524 | 9/20 | 0.35 |
| ▸ | NOTUM | Q6P988 | 2/20 | 0.33 |
| ▸ | OPRL1 | P41146 | 2/20 | 0.33 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL4757278 | 0.72 | CYP2C9 (0.34) | NOTUM | |
| SCHEMBL4755316 | 0.65 | HCAR2 (0.36) | HCAR2HDAC4NOTUM | |
| SCHEMBL9505359 | 0.61 | KDM4E (0.49) | — | |
| SCHEMBL7776061 | 0.60 | CRHBP (0.43) | HCAR2HDAC4OPRL1 | |
| SCHEMBL803450 | 0.57 | HDAC4 (0.40) | HCAR2HDAC4OPRL1 | |
| SCHEMBL20249893 | 0.57 | THRB (0.46) | HCAR2HDAC4OPRL1HDAC9 | |
| SCHEMBL31125559 | 0.56 | HDAC4 (0.59) | HCAR2HDAC4OPRL1 | |
| SCHEMBL301133 | 0.56 | HDAC4 (0.59) | HCAR2HDAC4OPRL1 | |
| Acetic Acid SCHEMBL27477632 | 0.56 | CES2 (0.52) | — | |
| SCHEMBL29177458 | 0.55 | OPRM1 (0.44) | HCAR2HDAC4NOTUMOPRL1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008006070-A2 | COMPOUNDS AND COMBINATIONS THEREOF FOR INHIBITING BETA-AMYLOID PRODUCTION AND METHODS OF USE THEREOF | ROSKAMP RESEARCH LLC (US) | 2008-01-10 | — | — | WO | disclosed |
| EP-1858325-A2 | COMPOUNDS FOR INHIBITING BETA-AMYLOID PRODUCTION AND METHODS OF IDENTIFYING THE COMPOUNDS | Roskamp Research LLC (US) | 2007-11-28 | — | — | EP | disclosed |
| WO-2006074419-A2 | COMPOUNDS FOR INHIBITING BETA-AMYLOID PRODUCTION AND METHODS OF IDENTIFYING THE COMPOUNDS | ROSKAMP RESEARCH LLC (US) | 2006-07-13 | — | — | WO | disclosed |