Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B1 | P14061 | 2/20 | 0.68 |
| ▸ | HSD17B2 | P37059 | 2/20 | 0.68 |
| ▸ | NPC1 | O15118 | 6/20 | 0.60 |
| ▸ | RAB9A | P51151 | 6/20 | 0.60 |
| ▸ | LMNA | P02545 | 5/20 | 0.60 |
| ▸ | MAPT | P10636 | 4/20 | 0.60 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.60 |
| ▸ | MEN1 | O00255 | 3/20 | 0.60 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.60 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.60 |
| ▸ | HTT | P42858 | 2/20 | 0.60 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.59 |
| ▸ | NFKB2 | Q00653 | 2/20 | 0.59 |
| ▸ | RELA | Q04206 | 2/20 | 0.59 |
| ▸ | PDE10A | Q9Y233 | 2/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.53 |
| ▸ | MCL1 | Q07820 | 2/20 | 0.52 |
| ▸ | BCL2 | P10415 | 1/20 | 0.52 |
| ▸ | BAD | Q92934 | 1/20 | 0.52 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL24751 | 0.87 | HSD17B1 (0.62) | HSD17B1HSD17B2NPC1RAB9ALMNA | |
| SCHEMBL1304947 | 0.86 | HSD17B1 (0.66) | HSD17B1HSD17B2NPC1RAB9ALMNA | |
| Bromide SCHEMBL28862925 | 0.85 | HSD17B1 (0.61) | HSD17B1HSD17B2NPC1RAB9ALMNA | |
| SCHEMBL14020213 | 0.84 | HSD17B1 (0.59) | HSD17B1HSD17B2NPC1RAB9ALMNA | |
| SCHEMBL28901460 | 0.84 | HSD17B1 (0.60) | HSD17B1HSD17B2NPC1RAB9ALMNA | |
| SCHEMBL14020417 | 0.84 | HSD17B1 (0.64) | HSD17B1HSD17B2NPC1RAB9ALMNA | |
| SCHEMBL11989060 | 0.84 | HSD17B1 (0.60) | HSD17B1HSD17B2NPC1RAB9ALMNA | |
| SCHEMBL6319718 | 0.83 | ALDH1A1 (0.66) | HSD17B1HSD17B2NPC1RAB9ALMNA | |
| SCHEMBL14020155 | 0.83 | PDE10A (0.58) | HSD17B1HSD17B2NPC1RAB9ALMNA | |
| SCHEMBL22526 | 0.81 | HSD17B1 (1.00) | HSD17B1HSD17B2ALDH1A1MCL1BCL2 |
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-2009058810-A1 | PROCESS FOR THE PREPARATION OF SUBSTITUTED 2,4,5,6,7,8-HEXAHYDRO-1,2,6-TRIAZA-AZULENE DERIVATIVES | JANSSEN PHARMACEUTICA N.V. (BE) | 2009-05-07 | — | — | WO | disclosed |