Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RXRA | P19793 | 16/20 | 1.00 |
| ▸ | RXRB | P28702 | 8/20 | 1.00 |
| ▸ | RXRG | P48443 | 8/20 | 1.00 |
| ▸ | CYP26A1 | O43174 | 2/20 | 0.67 |
| ▸ | RARB | P10826 | 5/20 | 0.60 |
| ▸ | RARG | P13631 | 5/20 | 0.60 |
| ▸ | RARA | P10276 | 4/20 | 0.60 |
| ▸ | MEN1 | O00255 | 1/20 | 0.58 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.58 |
| ▸ | ESR1 | P03372 | 1/20 | 0.58 |
| ▸ | PGR | P06401 | 1/20 | 0.58 |
| ▸ | HTR1A | P08908 | 1/20 | 0.58 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.58 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.58 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.58 |
| ▸ | DRD1 | P21728 | 1/20 | 0.58 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.58 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.58 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.58 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.58 |
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 | |
|---|---|---|---|---|
| SCHEMBL8894871 | 0.84 | RXRA (0.72) | RXRARXRBRXRGCYP26A1RARB | |
| SCHEMBL7723491 | 0.82 | RXRA (0.69) | RXRARXRBRXRGCYP26A1RARB | |
| SCHEMBL20278462 | 0.81 | CYP26A1 (1.00) | RXRARXRBRXRGCYP26A1RARB | |
| SCHEMBL8158237 | 0.78 | RXRA (0.63) | RXRARXRBRXRGCYP26A1RARB | |
| SCHEMBL726140 | 0.76 | RXRA (1.00) | RXRARXRBRXRGCYP26A1RARB | |
| SCHEMBL30054740 | 0.76 | RXRA (1.00) | RXRARXRBRXRGCYP26A1RARB | |
| SCHEMBL16874513 | 0.74 | RXRA (0.59) | RXRARXRBRXRGCYP26A1RARB | |
| Bexarotene SCHEMBL5322954 | 0.73 | RXRA (1.00) | RXRARXRBRXRGCYP26A1RARB | |
| SCHEMBL6891312 | 0.73 | RXRA (0.74) | RXRARXRBRXRGCYP26A1RARB | |
| Bexarotene SCHEMBL29412584 | 0.73 | RXRA (1.00) | RXRARXRBRXRGCYP26A1RARB |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-1997016422-A1 | SULFIDES, SULFOXIDES AND SULFONES DISUBSTITUTED WITH A TETRAHYDRONAPHTHALENYL, CHROMANYL, THIOCHROMANYL OR TETRAHYDROQUINOLINYL AND SUBSTITUTED PHENYL OR HETEROARYL GROUP, HAVING RETINOID-LIKE BIOLOGICAL ACTIVITY | ALLERGAN (US) | 1997-05-09 | — | — | WO | claimed |
| US-5672710-A | SPECIFIC AGONISTS FOR THE RXR RETINOID RECEPTOR RATHER THAN THE RAR ONE; SIDE EFFECT REDUCTION; SKIN AND NERVOUS SYTEM DISORDERS; ANTICARCINOGENIC AGENTS; VISION DEFECTS | ALLERGAN (US) | 1997-09-30 | — | — | US | disclosed |
| WO-1997016422-A1 | SULFIDES, SULFOXIDES AND SULFONES DISUBSTITUTED WITH A TETRAHYDRONAPHTHALENYL, CHROMANYL, THIOCHROMANYL OR TETRAHYDROQUINOLINYL AND SUBSTITUTED PHENYL OR HETEROARYL GROUP, HAVING RETINOID-LIKE BIOLOGICAL ACTIVITY | ALLERGAN (US) | 1997-05-09 | — | — | WO | disclosed |