Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | RXRA | P19793 | 14/20 | 0.38 |
| ▸ | RARB | P10826 | 10/20 | 0.38 |
| ▸ | RARG | P13631 | 8/20 | 0.38 |
| ▸ | RARA | P10276 | 5/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
| ▸ | RXRB | P28702 | 3/20 | 0.36 |
| ▸ | RXRG | P48443 | 3/20 | 0.36 |
| ▸ | HNF4A | P41235 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | CYP26A1 | O43174 | 1/20 | 0.35 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.35 |
| ▸ | ESR1 | P03372 | 1/20 | 0.35 |
| ▸ | PGR | P06401 | 1/20 | 0.35 |
| ▸ | HTR1A | P08908 | 1/20 | 0.35 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.35 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.35 |
| ▸ | CHRM1 | P11229 | 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 | |
|---|---|---|---|---|
| SCHEMBL8919744 | 0.79 | RXRA (0.44) | RXRARARBRARGRARARXRB | |
| SCHEMBL7778758 | 0.76 | TP53 (0.43) | TP53CYP1A2RXRARARBRARG | |
| SCHEMBL16861460 | 0.74 | ALDH1A1 (0.44) | TP53CYP1A2ALDH1A1ALOX15 | |
| SCHEMBL29119948 | 0.71 | ALDH1A1 (0.41) | TP53RARBRARGALDH1A1ALOX15 | |
| SCHEMBL23446684 | 0.71 | CYP1A2 (0.44) | TP53CYP1A2RXRARARBRARG | |
| SCHEMBL6430449 | 0.70 | RXRA (0.43) | TP53CYP1A2RXRARARBRARG | |
| SCHEMBL29119960 | 0.70 | ALDH1A1 (0.40) | RARBRARGRARAALDH1A1ALOX15 | |
| SCHEMBL7943899 | 0.70 | RARB (0.67) | TP53CYP1A2RXRARARBRARG | |
| SCHEMBL7943904 | 0.70 | RARB (0.67) | TP53CYP1A2RXRARARBRARG | |
| SCHEMBL7872153 | 0.69 | RXRA (0.59) | RXRARARBRARGRARARXRB |
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 |
|---|---|---|---|---|---|---|---|
| US-6326510-B1 | SKIN DISORDERS; ANTICANCER AGENTS | CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES (FR) | 2001-12-04 | — | — | US | disclosed |