Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 2/20 | 0.53 |
| ▸ | BCL9 | O00512 | 1/20 | 0.50 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.50 |
| ▸ | ESR1 | P03372 | 1/20 | 0.48 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.48 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.48 |
| ▸ | CES1 | P23141 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | LMNA | P02545 | 3/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | CES2 | O00748 | 1/20 | 0.46 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.46 |
| ▸ | CA1 | P00915 | 2/20 | 0.46 |
| ▸ | CA2 | P00918 | 2/20 | 0.46 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.46 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.46 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.46 |
| ▸ | GSK3B | P49841 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL13370393 | 0.88 | ESR1 (0.57) | MAPK1TDP1ESR1CYP19A1ESR2 | |
| SCHEMBL11025481 | 0.88 | ESR1 (0.57) | MAPK1TDP1ESR1CYP19A1ESR2 | |
| SCHEMBL29105352 | 0.79 | ESR1 (0.49) | MAPK1TDP1ESR1CYP19A1ESR2 | |
| SCHEMBL11099376 | 0.79 | MAPK1 (0.66) | MAPK1TDP1ESR1CYP19A1ESR2 | |
| SCHEMBL11099375 | 0.79 | MAPK1 (0.66) | MAPK1TDP1ESR1CYP19A1ESR2 | |
| SCHEMBL5863245 | 0.79 | CES2 (0.53) | MAPK1ESR1ESR2CES1LMNA | |
| SCHEMBL585941 | 0.79 | CES2 (0.53) | MAPK1ESR1ESR2CES1LMNA | |
| SCHEMBL28185861 | 0.78 | ALDH1A1 (0.49) | MAPK1BCL9CTNNB1TDP1ESR1 | |
| SCHEMBL9439988 | 0.77 | GSK3B (0.62) | MAPK1BCL9CTNNB1TDP1CES1 | |
| 4-Nitrobenzoic Acid SCHEMBL28404617 | 0.76 | TDP1 (0.70) | MAPK1BCL9CTNNB1TDP1CES1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0067954-B1 | ORGANIC PHOTOCONDUCTIVE COMPOSITIONS FOR ELECTROPHOTOGRAPHY | KABUSHIKI KAISHA TOSHIBA (JP) | 1985-08-28 | — | — | EP | claimed |