Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 7/20 | 0.40 |
| ▸ | CA1 | P00915 | 7/20 | 0.40 |
| ▸ | CA2 | P00918 | 7/20 | 0.40 |
| ▸ | CA9 | Q16790 | 7/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.36 |
| ▸ | THRB | P10828 | 2/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | CHRM2 | P08172 | 4/20 | 0.36 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.36 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.36 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.35 |
| ▸ | FYN | P06241 | 1/20 | 0.35 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.35 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.35 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.35 |
| ▸ | DRD4 | P21917 | 1/20 | 0.35 |
| ▸ | DRD3 | P35462 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL22522050 | 0.95 | CA12 (0.41) | CA12CA1CA2CA9CYP2D6 | |
| SCHEMBL22866536 | 0.84 | CA2 (0.47) | CA12CA1CA2CA9CYP2D6 | |
| SCHEMBL17205762 | 0.84 | CA2 (0.47) | CA12CA1CA2CA9CYP2D6 | |
| SCHEMBL20313792 | 0.83 | CA2 (0.46) | CA12CA1CA2CA9CYP2D6 | |
| SCHEMBL23374317 | 0.78 | CA12 (0.34) | CA12CA1CA2CA9CYP2D6 | |
| SCHEMBL14500640 | 0.78 | THRB (0.43) | CA12CA1CA2CA9CYP2D6 | |
| SCHEMBL22108040 | 0.77 | CA2 (0.39) | CA12CA1CA2CA9CYP2D6 | |
| SCHEMBL17550206 | 0.77 | ALDH1A1 (0.43) | HSD17B10CHRM2CHRM1CHRM4CHRM3 | |
| SCHEMBL24912279 | 0.77 | ALDH1A1 (0.43) | HSD17B10CHRM2CHRM1CHRM4CHRM3 | |
| SCHEMBL18053196 | 0.73 | CA2 (0.41) | CA12CA1CA2CA9CYP2D6 |
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-2018068090-A1 | THERAPEUTIC AGENTS AND METHODS OF PRODUCING SAME | GLYCAN BIOSCIENCES LLC (US) | 2018-04-19 | — | — | WO | disclosed |