Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR2 | P41597 | 1/20 | 0.33 |
| ▸ | ACHE | P22303 | 1/20 | 0.32 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.32 |
| ▸ | ADAMTS5 | Q9UNA0 | 1/20 | 0.32 |
| ▸ | RORC | P51449 | 2/20 | 0.32 |
| ▸ | CCR5 | P51681 | 2/20 | 0.30 |
| ▸ | TSHR | P16473 | 2/20 | 0.30 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL7085856 | 0.85 | ADAMTS5 (0.33) | CCR2ADAMTS5CCR5 | |
| SCHEMBL7200638 | 0.85 | TSHR (0.34) | CCR2ACHESIGMAR1RORCCCR5 | |
| SCHEMBL4863294 | 0.85 | CYP2D6 (0.34) | CCR2ACHESIGMAR1ADAMTS5RORC | |
| SCHEMBL4870323 | 0.84 | CYP2D6 (0.35) | CCR2ADAMTS5CCR5TSHR | |
| SCHEMBL4876317 | 0.82 | CD274 (0.35) | CCR2ADAMTS5CCR5 | |
| SCHEMBL4875372 | 0.82 | CYP2D6 (0.31) | KDM4EALDH1A1 | |
| SCHEMBL4875299 | 0.81 | KCNH2 (0.36) | CCR2CCR5 | |
| SCHEMBL27490110 | 0.81 | TSHR (0.33) | SIGMAR1RORCCCR5TSHRKDM4E | |
| SCHEMBL4863296 | 0.81 | CYP2D6 (0.36) | ACHESIGMAR1ADAMTS5 | |
| SCHEMBL4870351 | 0.80 | CYP2D6 (0.31) | KDM4EALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1289965-A1 | SUBSTITUTED 1-AMINOALKYL-LACTAMS AND THEIR USE AS MUSCARINIC RECEPTOR ANTAGONISTS | F. HOFFMANN-LA ROCHE AG (CH) | 2003-03-12 | — | — | EP | disclosed |
| WO-2001090081-A1 | SUBSTITUTED 1-AMINOALKYL-LACTAMS AND THEIR USE AS MUSCARINIC RECEPTOR ANTAGONISTS | F. HOFFMANN-LA ROCHE AG (CH) | 2001-11-29 | — | — | WO | disclosed |