Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HEXA | P06865 | 1/20 | 0.51 |
| ▸ | HEXB | P07686 | 1/20 | 0.51 |
| ▸ | TLR8 | Q9NR97 | 9/20 | 0.46 |
| ▸ | DPP4 | P27487 | 2/20 | 0.45 |
| ▸ | DHFR | P00374 | 2/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.38 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.38 |
| ▸ | TLR7 | Q9NYK1 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL28043777 | 0.80 | ADORA2A (0.51) | HEXAHEXBTLR8DPP4DHFR | |
| SCHEMBL27942788 | 0.77 | HEXA (0.54) | HEXAHEXBDPP4DHFRMKNK1 | |
| SCHEMBL28043971 | 0.76 | HEXA (0.55) | HEXAHEXBTLR8DPP4DHFR | |
| SCHEMBL16703398 | 0.76 | DHFR (0.43) | TLR8DHFRCYP2D6TLR7 | |
| SCHEMBL12368250 | 0.75 | HEXA (0.75) | HEXAHEXBDHFRCYP2D6 | |
| SCHEMBL468531 | 0.74 | CYP2D6 (0.53) | TLR8DHFRCYP2D6TLR7 | |
| SCHEMBL16701353 | 0.74 | DHFR (0.53) | TLR8DHFRCYP2D6TLR7 | |
| SCHEMBL27631813 | 0.72 | HEXA (0.51) | HEXAHEXBDPP4DHFRMKNK1 | |
| SCHEMBL6345470 | 0.72 | KMT2A (0.47) | HEXAHEXBTLR8DHFRCYP2D6 | |
| SCHEMBL12368244 | 0.71 | HEXA (0.79) | HEXAHEXBDHFRCYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2015069752-A9 | ACETYLCHOLINE BINDING PROTEIN LIGANDS, COOPERATIVE NACHR MODULATORS AND METHODS FOR MAKING AND USING | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 2015-07-09 | — | — | WO | disclosed |
| WO-2015069752-A1 | ACETYLCHOLINE BINDING PROTEIN LIGANDS, COOPERATIVE NACHR MODULATORS AND METHODS FOR MAKING AND USING | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 2015-05-14 | — | — | WO | disclosed |