Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 8/20 | 0.39 |
| ▸ | ESR2 | Q92731 | 7/20 | 0.39 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.39 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.39 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.33 |
| ▸ | BLM | P54132 | 1/20 | 0.33 |
| ▸ | DEGS1 | O15121 | 1/20 | 0.33 |
| ▸ | CA12 | O43570 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | CA7 | P43166 | 1/20 | 0.33 |
| ▸ | CA9 | Q16790 | 1/20 | 0.33 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | PGR | P06401 | 1/20 | 0.32 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.32 |
| ▸ | AR | P10275 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL6672417 | 0.85 | ESR1 (0.41) | ESR1ESR2PDCD1CD274BLM | |
| SCHEMBL7277613 | 0.77 | MEN1 (0.40) | ESR1ESR2CYP2C9NPY5R | |
| SCHEMBL27493803 | 0.71 | ESR1 (0.41) | ESR1ESR2PDCD1CD274BLM | |
| SCHEMBL25597560 | 0.70 | BLM (0.47) | ESR1ESR2PDCD1CD274BLM | |
| SCHEMBL22074723 | 0.70 | BLM (0.47) | ESR1ESR2PDCD1CD274BLM | |
| SCHEMBL22074727 | 0.70 | BLM (0.47) | ESR1ESR2PDCD1CD274BLM | |
| SCHEMBL6673967 | 0.70 | KDM4E (0.41) | ALOX5CYP1A2CYP2D6 | |
| SCHEMBL25596210 | 0.70 | ESR1 (0.52) | ESR1ESR2PDCD1CD274LMNA | |
| SCHEMBL9561475 | 0.70 | ESR1 (0.52) | ESR1ESR2PDCD1CD274LMNA | |
| SCHEMBL14411802 | 0.69 | ESR1 (0.56) | ESR1ESR2PDCD1CD274BLM |
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-2004026293-A2 | HEMIASTERLIN DERIVATIVES FOR TREATING RESISTANT TUMORS | WYETH HOLDINGS CORPORATION (US) | 2004-04-01 | — | — | WO | claimed |
| WO-2004026293-A2 | HEMIASTERLIN DERIVATIVES FOR TREATING RESISTANT TUMORS | WYETH HOLDINGS CORPORATION (US) | 2004-04-01 | — | — | WO | disclosed |