Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RXRA | P19793 | 2/20 | 0.49 |
| ▸ | RXRB | P28702 | 2/20 | 0.49 |
| ▸ | RXRG | P48443 | 2/20 | 0.49 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.49 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.44 |
| ▸ | RELA | Q04206 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | ADORA2A | P29274 | 4/20 | 0.42 |
| ▸ | ADORA1 | P30542 | 4/20 | 0.42 |
| ▸ | ADORA2B | P29275 | 2/20 | 0.42 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.41 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.41 |
| ▸ | NOTUM | Q6P988 | 3/20 | 0.40 |
| ▸ | IDO1 | P14902 | 1/20 | 0.40 |
| ▸ | HTR7 | P34969 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL11745189 | 0.94 | RXRA (0.56) | RXRARXRBRXRGNR4A2NPC1 | |
| SCHEMBL11755155 | 0.94 | RXRA (0.56) | RXRARXRBRXRGNR4A2NPC1 | |
| SCHEMBL11752455 | 0.85 | ADORA1 (0.56) | RXRARXRBRXRGNR4A2NPC1 | |
| SCHEMBL11751845 | 0.85 | RXRA (0.44) | RXRARXRBRXRGNR4A2NPC1 | |
| SCHEMBL11749454 | 0.85 | RXRA (0.44) | RXRARXRBRXRGNR4A2NPC1 | |
| SCHEMBL11754386 | 0.83 | RXRA (0.51) | RXRARXRBRXRGNR4A2NPC1 | |
| SCHEMBL11752754 | 0.80 | RAB9A (0.44) | NPC1TP53TSHRRAB9ASMN1; SMN2 | |
| SCHEMBL11750686 | 0.80 | ADORA2A (0.41) | RXRARXRBRXRGNR4A2TP53 | |
| SCHEMBL11752538 | 0.77 | RXRA (0.55) | RXRARXRBRXRGNR4A2TSHR | |
| SCHEMBL11751923 | 0.77 | RXRA (0.59) | RXRARXRBRXRGNR4A2NPC1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4051250-A | OXAZOLE, THIAZOLE | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DT) | 1977-09-27 | — | — | US | disclosed |
| US-3933840-A | ANTIPHLOGISTIC | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DT) | 1976-01-20 | — | — | US | disclosed |