Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM3 | P20309 | 9/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | CHRM2 | P08172 | 6/20 | 0.40 |
| ▸ | CHRM1 | P11229 | 6/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | HTR2A | P28223 | 2/20 | 0.34 |
| ▸ | CCR1 | P32246 | 2/20 | 0.33 |
| ▸ | HTR1A | P08908 | 1/20 | 0.33 |
| ▸ | DRD2 | P14416 | 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 | |
|---|---|---|---|---|
| Trifluoroacetic Acid SCHEMBL5534438 | 0.95 | CHRM3 (0.48) | CHRM3MEN1KMT2AMAPTCHRM2 | |
| Trifluoroacetic Acid SCHEMBL5546014 | 0.94 | CHRM3 (0.49) | CHRM3MEN1KMT2AMAPTCHRM2 | |
| SCHEMBL6423109 | 0.89 | CHRM3 (0.54) | CHRM3MEN1KMT2AMAPTCHRM2 | |
| Trifluoroacetic Acid SCHEMBL6420994 | 0.88 | CHRM3 (0.45) | CHRM3MEN1KMT2AMAPTCHRM2 | |
| Trifluoroacetic Acid SCHEMBL5538285 | 0.84 | CHRM3 (0.50) | CHRM3CHRM2CHRM1CCR1 | |
| Trifluoroacetic Acid SCHEMBL5533187 | 0.83 | CHRM3 (0.49) | CHRM3CHRM2CHRM1KDM4ECCR1 | |
| Trifluoroacetic Acid SCHEMBL5535488 | 0.81 | CHRM3 (0.46) | CHRM3MEN1KMT2AMAPTCHRM2 | |
| Trifluoroacetic Acid SCHEMBL5544783 | 0.79 | CHRM3 (0.49) | CHRM3CHRM2CHRM1CCR1 | |
| Trifluoroacetic Acid SCHEMBL5538291 | 0.78 | CHRM3 (0.44) | CHRM3MEN1KMT2AMAPTCHRM2 | |
| SCHEMBL6417797 | 0.77 | CHRM3 (0.54) | CHRM3CHRM2CHRM1KDM4ECCR1 |
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-1497284-A2 | PYRROLIDINIUM DERIVATIVES AS ANTAGONISTS OF M3 MUSCARINIC RECEPTORS | Almirall Prodesfarma AG (CH) | 2005-01-19 | — | — | EP | disclosed |
| WO-2003087094-A2 | PYRROLIDINIUM DERIVATIVES AS ANTAGONISTS OF M3 MUSCARINIC RECEPTORS | ALMIRALL PRODESFARMA AG (CH) | 2003-10-23 | — | — | WO | disclosed |