Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC3 | O15379 | 1/20 | 0.37 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.37 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.37 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.37 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.37 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.37 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.37 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.37 |
| ▸ | GAPDH | P04406 | 1/20 | 0.37 |
| ▸ | HSPA1A | P0DMV8 | 1/20 | 0.37 |
| ▸ | HSPA8 | P11142 | 1/20 | 0.37 |
| ▸ | PTPN7 | P35236 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | CA12 | O43570 | 1/20 | 0.35 |
| ▸ | CA1 | P00915 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | CA7 | P43166 | 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 | |
|---|---|---|---|---|
| SCHEMBL28102236 | 0.85 | POLB (0.37) | HDAC3HDAC4HDAC7HDAC8HDAC6 | |
| SCHEMBL9161966 | 0.82 | CA12 (0.57) | HDAC3HDAC4HDAC7HDAC8HDAC6 | |
| SCHEMBL7796836 | 0.81 | CYP2C9 (0.49) | CYP2C9CA12CA1CA2CA7 | |
| SCHEMBL16771295 | 0.75 | GAPDH (0.41) | GAPDHHSPA1AHSPA8PTPN7CA12 | |
| SCHEMBL4851263 | 0.74 | CA12 (0.52) | CYP1A2TSHRCA12CA1CA2 | |
| SCHEMBL5667417 | 0.72 | FOLH1 (0.44) | HDAC3HDAC4HDAC7HDAC8HDAC6 | |
| SCHEMBL28531858 | 0.71 | FOLH1 (0.53) | CYP2C9CA12CA1CA2CA7 | |
| SCHEMBL6636937 | 0.71 | MYC (0.49) | CYP2C9POLBCA12CA1CA2 | |
| SCHEMBL3405052 | 0.70 | MMP2 (0.45) | HDAC3NCOR2TSHRCA12CA1 | |
| SCHEMBL3034481 | 0.67 | ALDH1A1 (0.50) | HDAC8TSHRCA12CA1CA2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-105530923-A | Aryl ethers and their use | PELOTON THERAPEUTICS INC | 2016-04-27 | — | — | CN | disclosed |