Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA9 | Q16790 | 8/20 | 0.48 |
| ▸ | CA12 | O43570 | 7/20 | 0.48 |
| ▸ | CA1 | P00915 | 7/20 | 0.48 |
| ▸ | CA2 | P00918 | 7/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | THRB | P10828 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.38 |
| ▸ | FYN | P06241 | 1/20 | 0.38 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.38 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.38 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.38 |
| ▸ | DRD4 | P21917 | 1/20 | 0.38 |
| ▸ | DRD3 | P35462 | 1/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 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 | |
|---|---|---|---|---|
| SCHEMBL20419271 | 0.89 | CA12 (0.42) | CA9CA12CA1CA2CYP2D6 | |
| SCHEMBL12721608 | 0.89 | CA12 (0.42) | CA9CA12CA1CA2CYP2D6 | |
| SCHEMBL12721631 | 0.89 | CA12 (0.42) | CA9CA12CA1CA2CYP2D6 | |
| SCHEMBL25947772 | 0.89 | CA12 (0.42) | CA9CA12CA1CA2CYP2D6 | |
| SCHEMBL14429363 | 0.87 | CA9 (0.41) | CA9CA12CA1CA2CYP2D6 | |
| SCHEMBL16127067 | 0.85 | CA12 (0.48) | CA9CA12CA1CA2CYP2D6 | |
| SCHEMBL14429364 | 0.85 | CA9 (0.40) | CA9CA12CA1CA2CYP2D6 | |
| SCHEMBL20068297 | 0.85 | CA2 (0.48) | CA9CA12CA1CA2CYP2D6 | |
| SCHEMBL8431814 | 0.85 | CA2 (0.48) | CA9CA12CA1CA2CYP2D6 | |
| SCHEMBL11540698 | 0.85 | CA2 (0.48) | CA9CA12CA1CA2CYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| US-9919055-B2 | Sugar-linker-drug conjugates | ARIZONA BOARD OF REGENTS ON BEHALF OF ARIZONA STATE UNIVERSITY (US) | 2018-03-20 | — | — | US | disclosed |