Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TBXAS1 | P24557 | 2/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.36 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | CNOT7 | Q9UIV1 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | ESR1 | P03372 | 1/20 | 0.34 |
| ▸ | RARB | P10826 | 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 | |
|---|---|---|---|---|
| SCHEMBL6855922 | 0.92 | TBXAS1 (0.37) | TBXAS1LMNAHSD17B10KMT2AADORA3 | |
| SCHEMBL6849821 | 0.89 | LMNA (0.40) | TBXAS1LMNAKMT2AADORA3 | |
| SCHEMBL6855523 | 0.88 | TSHR (0.39) | HRH3TSHRNPC1RAB9AHSD17B10 | |
| SCHEMBL6853830 | 0.80 | NOTUM (0.39) | HRH3TSHRLMNAHSD17B10KMT2A | |
| SCHEMBL22040159 | 0.78 | JMJD6 (0.45) | TSHRNPC1RAB9AKMT2AADORA3 | |
| SCHEMBL6855286 | 0.77 | KMT2A (0.40) | TSHRKMT2AADORA3L3MBTL1 | |
| SCHEMBL4670651 | 0.75 | KMT2A (0.39) | TSHRKMT2AADORA3L3MBTL1 | |
| SCHEMBL24842047 | 0.74 | ADRB3 (0.40) | HRH3NPC1RAB9AKMT2ATDP1 | |
| SCHEMBL29446057 | 0.74 | ALDH1A1 (0.36) | TBXAS1LMNANPC1RAB9AKMT2A | |
| SCHEMBL9461194 | 0.74 | JMJD6 (0.44) | TSHRNPC1RAB9AKMT2AADORA3 |
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-6831177-B1 | Preparation of their intermediates, 2-acyl-5-benzylfuran derivatives and 1,2,4-triazole-3- carboxylic acid ester derivatives | SHIONOGI & CO., LTD. (JP) | 2004-12-14 | — | — | US | disclosed |
| EP-1186599-A1 | NOVEL PROCESSES FOR THE PREPARATION OF SUBSTITUTED PROPENONE DERIVATIVES | SHIONOGI & CO., LTD. (JP) | 2002-03-13 | — | — | EP | disclosed |