Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM3 | P20309 | 5/20 | 0.39 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.39 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.35 |
| ▸ | LTA4H | P09960 | 2/20 | 0.35 |
| ▸ | CCR5 | P51681 | 1/20 | 0.35 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | CA2 | P00918 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL7368147 | 0.83 | CYP2B6 (0.43) | CHRM3CHRM2CHRM1LTA4HSIGMAR1 | |
| SCHEMBL7368148 | 0.83 | CYP2B6 (0.43) | CHRM3CHRM2CHRM1LTA4HSIGMAR1 | |
| SCHEMBL10547718 | 0.70 | LTA4H (0.48) | CHRM3CHRM2CHRM1LTA4H | |
| SCHEMBL4703694 | 0.70 | ALDH1A1 (0.62) | ALDH1A1KDM4EPOLB | |
| SCHEMBL7364432 | 0.66 | CHRM3 (0.39) | CHRM3CHRM2CHRM1SIGMAR1 | |
| SCHEMBL12207405 | 0.65 | ALDH1A1 (0.63) | ALDH1A1KDM4EPOLB | |
| SCHEMBL4391647 | 0.65 | ALDH1A1 (0.49) | CHRM3ALDH1A1KDM4EPOLBMEN1 | |
| SCHEMBL2392136 | 0.65 | CYP2B6 (0.59) | CHRM3CHRM2CHRM1ALDH1A1KDM4E | |
| SCHEMBL6028844 | 0.65 | CHRM3 (0.43) | CHRM3CHRM2CHRM1 | |
| SCHEMBL27570108 | 0.65 | HTR2A (0.46) | LTA4HSIGMAR1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-1998042656-A1 | NOVEL COMPOUNDS | CYTEL CORPORATION (US) | 1998-10-01 | — | — | WO | disclosed |