Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H2 | P55055 | 4/20 | 0.53 |
| ▸ | NR1H3 | Q13133 | 4/20 | 0.53 |
| ▸ | NPC1 | O15118 | 4/20 | 0.53 |
| ▸ | RAB9A | P51151 | 4/20 | 0.53 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.49 |
| ▸ | TDP2 | O95551 | 3/20 | 0.45 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.45 |
| ▸ | KDM4C | Q9H3R0 | 2/20 | 0.45 |
| ▸ | TRIM24 | O15164 | 1/20 | 0.41 |
| ▸ | TRIM33 | Q9UPN9 | 1/20 | 0.41 |
| ▸ | BRD4 | O60885 | 1/20 | 0.41 |
| ▸ | CA12 | O43570 | 1/20 | 0.40 |
| ▸ | CA1 | P00915 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | CA9 | Q16790 | 1/20 | 0.40 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.40 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL6580839 | 0.87 | KDM4C (0.49) | NR1H2NR1H3NPC1RAB9AHSD17B2 | |
| SCHEMBL6581289 | 0.83 | DRD1 (0.46) | NR1H2NR1H3NPC1RAB9AHSD17B2 | |
| SCHEMBL6578166 | 0.82 | HSD17B2 (0.51) | NR1H2NR1H3NPC1RAB9AHSD17B2 | |
| SCHEMBL6580847 | 0.80 | TDP2 (0.44) | NR1H2NR1H3NPC1RAB9AHSD17B2 | |
| Pyrrolidine SCHEMBL6582654 | 0.80 | KDM4C (0.43) | NR1H2NR1H3NPC1RAB9AHSD17B2 | |
| SCHEMBL17279740 | 0.76 | NR1H3 (0.82) | NR1H2NR1H3NPC1RAB9AHSD17B2 | |
| SCHEMBL2321575 | 0.76 | TRIM24 (0.61) | NPC1RAB9ATRIM24TRIM33BRD4 | |
| SCHEMBL30249928 | 0.76 | TRIM24 (0.61) | NPC1RAB9ATRIM24TRIM33BRD4 | |
| SCHEMBL6581696 | 0.75 | NR1H2 (0.51) | NR1H2NR1H3NPC1RAB9AHSD17B2 | |
| SCHEMBL6581290 | 0.74 | NR1H2 (0.50) | NR1H2NR1H3NPC1RAB9AHSD17B2 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1148357-C | Triazole and imidazole derivative | - | 2004-05-05 | — | — | CN | disclosed |
| EP-1070708-B1 | Triazole derivatives | HOFFMANN LA ROCHE (CH) | 2004-01-14 | — | — | EP | disclosed |
| US-6265426-B1 | CENTRAL NERVOUS SYSTEM DISORDERS | HOFFMANN-LA ROCHE INC. | 2001-07-24 | — | — | US | disclosed |
| CN-1281852-A | Triazole and imidazole derivative | HOFFMANN LA ROCHE (CH) | 2001-01-31 | — | — | CN | disclosed |
| EP-1070708-A1 | Triazole and imidazole derivatives | F. HOFFMANN-LA ROCHE AG (CH) | 2001-01-24 | — | — | EP | disclosed |