Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1I3 | Q14994 | 1/20 | 0.53 |
| ▸ | DPP4 | P27487 | 1/20 | 0.53 |
| ▸ | NPC1 | O15118 | 2/20 | 0.49 |
| ▸ | RAB9A | P51151 | 2/20 | 0.49 |
| ▸ | TP53 | P04637 | 1/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.49 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.49 |
| ▸ | RELA | Q04206 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.49 |
| ▸ | ABCG2 | Q9UNQ0 | 2/20 | 0.48 |
| ▸ | PDE5A | O76074 | 2/20 | 0.48 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.48 |
| ▸ | ABCC1 | P33527 | 1/20 | 0.48 |
| ▸ | IDO1 | P14902 | 1/20 | 0.47 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.47 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.47 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.46 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 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 | |
|---|---|---|---|---|
| SCHEMBL30340724 | 1.00 | NR1I3 (0.53) | NR1I3DPP4NPC1RAB9ATP53 | |
| SCHEMBL18180907 | 1.00 | NR1I3 (0.53) | NR1I3DPP4NPC1RAB9ATP53 | |
| SCHEMBL19885953 | 0.98 | NR1I3 (0.51) | NR1I3DPP4NPC1RAB9ATP53 | |
| SCHEMBL30775127 | 0.98 | NR1I3 (0.51) | NR1I3DPP4NPC1RAB9ATP53 | |
| SCHEMBL18982932 | 0.98 | NR1I3 (0.51) | NR1I3DPP4NPC1RAB9ATP53 | |
| SCHEMBL23300317 | 0.98 | NR1I3 (0.51) | NR1I3DPP4NPC1RAB9ATP53 | |
| SCHEMBL19916975 | 0.98 | NR1I3 (0.51) | NR1I3DPP4NPC1RAB9ATP53 | |
| SCHEMBL30775097 | 0.98 | NR1I3 (0.51) | NR1I3DPP4NPC1RAB9ATP53 | |
| SCHEMBL22092339 | 0.98 | NR1I3 (0.51) | NR1I3DPP4NPC1RAB9ATP53 | |
| SCHEMBL15683875 | 0.98 | NR1I3 (0.54) | NR1I3DPP4NPC1RAB9ATP53 |
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-2023125801-A1 | FLUORANTHENE DERIVATIVE, LIGHT-EMITTING ELEMENT, AND PHOTOELECTRIC CONVERSION ELEMENT | 东丽先端材料研究开发（中国）有限公司 | 2023-07-06 | — | — | WO | disclosed |