Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RXRA | P19793 | 9/20 | 0.40 |
| ▸ | PPARG | P37231 | 8/20 | 0.40 |
| ▸ | RARG | P13631 | 4/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | TNFRSF1A | P19438 | 2/20 | 0.35 |
| ▸ | DHFR | P00374 | 1/20 | 0.34 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.33 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.33 |
| ▸ | HTR2A | P28223 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | RARA | P10276 | 1/20 | 0.32 |
| ▸ | RARB | P10826 | 1/20 | 0.32 |
| ▸ | RXRB | P28702 | 1/20 | 0.32 |
| ▸ | RXRG | P48443 | 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 | |
|---|---|---|---|---|
| SCHEMBL13368066 | 0.84 | RXRA (0.40) | RXRAPPARGRARGALDH1A1TSHR | |
| SCHEMBL4734116 | 0.84 | RXRA (0.47) | RXRAPPARGRARGALDH1A1TSHR | |
| SCHEMBL4731223 | 0.81 | CYP2C19 (0.30) | CYP2C19 | |
| SCHEMBL7921794 | 0.80 | RXRA (0.50) | RXRAPPARGRARGRARARARB | |
| SCHEMBL6407060 | 0.79 | MAPT (0.42) | RXRAPPARGRARGALDH1A1TSHR | |
| SCHEMBL15590742 | 0.79 | RXRA (0.36) | RXRAPPARGRARGALDH1A1TSHR | |
| SCHEMBL4730685 | 0.79 | DHFR (0.43) | RXRAPPARGRARGALDH1A1TSHR | |
| SCHEMBL4729047 | 0.78 | ALDH1A1 (0.45) | ALDH1A1TSHRPTGS2CYP2C19 | |
| SCHEMBL2947022 | 0.78 | PTGS2 (0.47) | RXRAPPARGRARGALDH1A1TSHR | |
| SCHEMBL7796138 | 0.78 | RXRA (0.44) | RXRAPPARGRARGALDH1A1TSHR |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008052288-A1 | DITHIOLE COMPOUNDS AS COX INHIBITORS | NEURO THERAPEUTICS LIMITED (AU) | 2008-05-08 | — | — | WO | disclosed |