Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | STAT3 | P40763 | 1/20 | 0.46 |
| ▸ | CA2 | P00918 | 10/20 | 0.40 |
| ▸ | CA1 | P00915 | 8/20 | 0.40 |
| ▸ | CA9 | Q16790 | 6/20 | 0.40 |
| ▸ | CA6 | P23280 | 3/20 | 0.39 |
| ▸ | CA12 | O43570 | 3/20 | 0.39 |
| ▸ | CA4 | P22748 | 2/20 | 0.39 |
| ▸ | CA5A | P35218 | 2/20 | 0.39 |
| ▸ | CA7 | P43166 | 2/20 | 0.39 |
| ▸ | CA5B | Q9Y2D0 | 2/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.39 |
| ▸ | CDK2 | P24941 | 1/20 | 0.39 |
| ▸ | PNMT | P11086 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 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 | |
|---|---|---|---|---|
| SCHEMBL15570709 | 0.81 | STAT3 (0.54) | STAT3CA2CA1CA9CA6 | |
| SCHEMBL16738815 | 0.77 | HTR6 (0.44) | CYP2C9ALDH1A1GAAHPGD | |
| SCHEMBL16745636 | 0.75 | TYMS (0.39) | CYP2C9ALDH1A1GAAKDM4EHPGD | |
| SCHEMBL31387014 | 0.74 | POLB (0.46) | STAT3CA2CA1CA9CA12 | |
| SCHEMBL30402468 | 0.73 | STAT3 (0.41) | STAT3CA2CA1CA9CA6 | |
| SCHEMBL389461 | 0.72 | PARP1 (0.56) | CA2CA1CA9CA7ALDH1A1 | |
| SCHEMBL29429928 | 0.72 | PARP10 (0.56) | CA2CA1CA9CA7ALDH1A1 | |
| SCHEMBL163925 | 0.72 | PARP10 (0.56) | CA2CA1CA9CA7ALDH1A1 | |
| SCHEMBL2480404 | 0.72 | PARP1 (0.56) | ALDH1A1GAAKDM4EHPGD | |
| SCHEMBL29392687 | 0.72 | PARP1 (0.56) | CA2CA1CA9CA7ALDH1A1 |
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 |