Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 3/20 | 0.47 |
| ▸ | RXRA | P19793 | 17/20 | 0.46 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.46 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.46 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.46 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.46 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.46 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.46 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.46 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.46 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.46 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.46 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.46 |
| ▸ | RXRG | P48443 | 10/20 | 0.46 |
| ▸ | RXRB | P28702 | 9/20 | 0.46 |
| ▸ | CYP26A1 | O43174 | 3/20 | 0.46 |
| ▸ | RARA | P10276 | 2/20 | 0.46 |
| ▸ | RARB | P10826 | 2/20 | 0.46 |
| ▸ | RARG | P13631 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL7799983 | 0.90 | RXRA (0.56) | RXRARXRGRXRBCYP26A1RARA | |
| SCHEMBL8093197 | 0.90 | CYP3A4 (0.54) | CYP3A4RXRAHDAC3HDAC4HDAC1 | |
| SCHEMBL6735362 | 0.81 | CYP3A4 (0.54) | CYP3A4RXRAHDAC3HDAC4HDAC1 | |
| SCHEMBL6733878 | 0.81 | CYP3A4 (0.71) | CYP3A4RXRARXRGRXRBCYP26A1 | |
| SCHEMBL8099423 | 0.80 | CYP3A4 (0.43) | CYP3A4RXRARXRGRXRBCYP26A1 | |
| SCHEMBL8099280 | 0.80 | RXRA (0.43) | CYP3A4RXRARXRGRXRBCYP26A1 | |
| SCHEMBL8094159 | 0.79 | CYP3A4 (0.56) | CYP3A4RXRARXRGRXRBCYP26A1 | |
| SCHEMBL7802063 | 0.79 | RXRA (0.54) | CYP3A4RXRARXRGRXRBCYP26A1 | |
| SCHEMBL20876235 | 0.76 | MAPT (0.46) | — | |
| SCHEMBL2594347 | 0.75 | RXRA (0.73) | CYP3A4RXRAHDAC3HDAC4HDAC1 |
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-6030952-A | AS HUMAN AND VETERINARY MEDICINE, PARTICULARLY IN THE TREATMENT OF DERMATOLOGICAL, RHEUMATIC, RESPIRATORY, CARDIOVASCULAR AND OPHTHALMOLOGIC CONDITIONS, AND IN COSMETIC COMPOSITIONS | CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIOUES GALDERMA (FR) | 2000-02-29 | — | — | US | disclosed |