Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.56 |
| ▸ | GRIA4 | P48058 | 4/20 | 0.51 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | TYR | P14679 | 1/20 | 0.39 |
| ▸ | PDE2A | O00408 | 1/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.38 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.38 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL5878391 | 1.00 | TAAR1 (0.56) | TAAR1GRIA4TSHRLMNATP53 | |
| SCHEMBL3006604 | 0.83 | TAAR1 (0.75) | TAAR1TSHRALDH1A1 | |
| Hydrochloric Acid SCHEMBL6564727 | 0.81 | TAAR1 (0.71) | TAAR1TSHR | |
| SCHEMBL792982 | 0.81 | TAAR1 (0.54) | TAAR1PDE2AALDH1A1 | |
| SCHEMBL548052 | 0.80 | GRIA4 (0.53) | GRIA4TSHRLMNATP53TYR | |
| SCHEMBL18092983 | 0.80 | GRIA4 (0.53) | GRIA4TSHRLMNATP53TYR | |
| SCHEMBL6968539 | 0.79 | TAAR1 (0.59) | TAAR1GRIA4TSHRLMNATP53 | |
| SCHEMBL13557448 | 0.78 | GRIA4 (0.51) | GRIA4TSHRLMNATP53TYR | |
| SCHEMBL19574100 | 0.78 | GRIA4 (0.51) | GRIA4TSHRLMNATP53TYR | |
| SCHEMBL11660622 | 0.78 | TSHR (0.41) | GRIA4TSHRLMNATP53TYR |
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 |