Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.52 |
| ▸ | TSHR | P16473 | 3/20 | 0.52 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.47 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | AHR | P35869 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 6/20 | 0.44 |
| ▸ | MEN1 | O00255 | 4/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.44 |
| ▸ | MAPT | P10636 | 4/20 | 0.44 |
| ▸ | S100A4 | P26447 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.43 |
| ▸ | MAOA | P21397 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 2/20 | 0.42 |
| ▸ | RAB9A | P51151 | 2/20 | 0.42 |
| ▸ | CRHR1 | P34998 | 2/20 | 0.42 |
| ▸ | GPR3 | P46089 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL28055423 | 0.87 | HSD17B10 (0.61) | HSD17B10TSHRHSP90AA1ALDH1A1CYP3A4 | |
| SCHEMBL665598 | 0.87 | HSD17B10 (0.61) | HSD17B10TSHRHSP90AA1ALDH1A1CYP3A4 | |
| Water SCHEMBL7522925 | 0.85 | HSD17B10 (0.58) | HSD17B10TSHRHSP90AA1ALDH1A1CYP3A4 | |
| SCHEMBL17916235 | 0.83 | HSP90AA1 (0.56) | HSD17B10TSHRHSP90AA1HSP90AB1ALDH1A1 | |
| SCHEMBL2934558 | 0.82 | AHR (0.52) | HSD17B10TSHRALDH1A1CYP3A4TDP1 | |
| SCHEMBL29416163 | 0.82 | AHR (0.52) | HSD17B10TSHRALDH1A1CYP3A4TDP1 | |
| SCHEMBL9616143 | 0.81 | ALDH1A1 (0.46) | HSD17B10TSHRHSP90AA1HSP90AB1ALDH1A1 | |
| SCHEMBL11648873 | 0.81 | TSHR (0.48) | HSD17B10TSHRALDH1A1CYP3A4TDP1 | |
| SCHEMBL28716910 | 0.80 | GRM2 (0.46) | HSD17B10TSHRHSP90AA1HSP90AB1ALDH1A1 | |
| SCHEMBL4221663 | 0.80 | KMT2A (0.45) | HSD17B10TSHRHSP90AA1HSP90AB1ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3215231-B1 | CAPSULE COMPOSITION | GIVAUDAN SA (CH) | 2020-12-16 | — | — | EP | disclosed |
| WO-2019143110-A1 | ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT ELEMENT USING SAME | 주식회사 두산 | 2019-07-25 | — | — | WO | disclosed |