Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RXRA | P19793 | 5/20 | 0.46 |
| ▸ | NR1H2 | P55055 | 5/20 | 0.46 |
| ▸ | NR1H3 | Q13133 | 5/20 | 0.46 |
| ▸ | CPT2 | P23786 | 1/20 | 0.40 |
| ▸ | CPT1A | P50416 | 1/20 | 0.40 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 3/20 | 0.36 |
| ▸ | NPC1 | O15118 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | SLC16A3 | O15427 | 2/20 | 0.36 |
| ▸ | SLC16A1 | P53985 | 1/20 | 0.36 |
| ▸ | MCTS1 | Q9ULC4 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 2/20 | 0.35 |
| ▸ | CA9 | Q16790 | 2/20 | 0.35 |
| ▸ | CA12 | O43570 | 1/20 | 0.35 |
| ▸ | CA1 | P00915 | 1/20 | 0.35 |
| ▸ | CNR1 | P21554 | 2/20 | 0.35 |
| ▸ | TP53 | P04637 | 2/20 | 0.34 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL16587445 | 0.93 | RXRA (0.46) | RXRANR1H2NR1H3CPT2CPT1A | |
| SCHEMBL16455621 | 0.89 | RXRA (0.54) | RXRANR1H2NR1H3CPT2CPT1A | |
| SCHEMBL16587285 | 0.88 | HAVCR2 (0.42) | RAB9ANPC1SMN1; SMN2ALDH1A1CNR1 | |
| SCHEMBL16455248 | 0.88 | NR1H2 (0.47) | RXRANR1H2NR1H3CPT2CPT1A | |
| SCHEMBL15242929 | 0.87 | NR1H2 (0.46) | RXRANR1H2NR1H3CPT2CPT1A | |
| SCHEMBL16587444 | 0.84 | NR1H2 (0.44) | RXRANR1H2NR1H3CPT2CPT1A | |
| SCHEMBL16455610 | 0.84 | RXRA (0.53) | RXRANR1H2NR1H3CPT2CPT1A | |
| SCHEMBL16455283 | 0.83 | RXRA (0.54) | RXRANR1H2NR1H3S1PR1RAB9A | |
| SCHEMBL16455252 | 0.82 | NR1H2 (0.46) | RXRANR1H2NR1H3CPT2CPT1A | |
| SCHEMBL15242880 | 0.82 | NR1H2 (0.46) | RXRANR1H2NR1H3CPT2CPT1A |
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-8987318-B2 | Liver X receptor (LXR) modulators for the treatment of dermal diseases, disorders and conditions | ALEXAR THERAPEUTICS, INC. (US) | 2015-03-24 | — | — | US | disclosed |