Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B1 | P14061 | 1/20 | 0.60 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.60 |
| ▸ | PDE10A | Q9Y233 | 2/20 | 0.60 |
| ▸ | GLO1 | Q04760 | 1/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.53 |
| ▸ | BCL2 | P10415 | 1/20 | 0.52 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.52 |
| ▸ | BAD | Q92934 | 1/20 | 0.52 |
| ▸ | MAPT | P10636 | 3/20 | 0.51 |
| ▸ | MEN1 | O00255 | 1/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.51 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.51 |
| ▸ | RAB9A | P51151 | 4/20 | 0.50 |
| ▸ | NPC1 | O15118 | 3/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.50 |
| ▸ | LMNA | P02545 | 2/20 | 0.50 |
| ▸ | HPGD | P15428 | 2/20 | 0.50 |
| ▸ | PKM | P14618 | 1/20 | 0.50 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.50 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.50 |
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) | HSD17B1HSD17B2PDE10AALDH1A1BCL2 | |
| SCHEMBL1304947 | 0.86 | HSD17B1 (0.66) | HSD17B1HSD17B2PDE10AGLO1ALDH1A1 | |
| Bromide SCHEMBL28862925 | 0.85 | HSD17B1 (0.61) | HSD17B1HSD17B2PDE10AALDH1A1BCL2 | |
| SCHEMBL11989060 | 0.84 | HSD17B1 (0.60) | HSD17B1HSD17B2PDE10AGLO1ALDH1A1 | |
| SCHEMBL4088536 | 0.84 | HSD17B1 (0.68) | HSD17B1HSD17B2PDE10AALDH1A1BCL2 | |
| SCHEMBL14020417 | 0.84 | HSD17B1 (0.64) | HSD17B1HSD17B2PDE10AALDH1A1BCL2 | |
| SCHEMBL6319718 | 0.83 | ALDH1A1 (0.66) | HSD17B1HSD17B2ALDH1A1MCL1MAPT | |
| SCHEMBL14020155 | 0.83 | PDE10A (0.58) | HSD17B1HSD17B2PDE10AALDH1A1BCL2 | |
| SCHEMBL14020147 | 0.82 | HSD17B1 (0.56) | HSD17B1HSD17B2PDE10ABCL2MCL1 | |
| SCHEMBL14020211 | 0.82 | HSD17B1 (0.58) | HSD17B1HSD17B2PDE10ABCL2MCL1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-108906053-B | Hydrophobic hydrotalcite loaded bimetallic catalyst and oxidation catalysis application thereof | 中国科学院兰州化学物理研究所苏州研究院 | 2020-11-03 | — | — | CN | disclosed |