Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.45 |
| ▸ | MYC | P01106 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.40 |
| ▸ | HPGD | P15428 | 3/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.36 |
| ▸ | TTR | P02766 | 3/20 | 0.36 |
| ▸ | FTO | Q9C0B1 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.36 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.36 |
| ▸ | AKR1C3 | P42330 | 2/20 | 0.36 |
| ▸ | AKR1B10 | O60218 | 1/20 | 0.36 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.36 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.36 |
| ▸ | FABP2 | P12104 | 1/20 | 0.36 |
| ▸ | RXRA | P19793 | 1/20 | 0.36 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.36 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL28700947 | 0.84 | MYC (0.43) | TSHRMYCALDH1A1HSD17B10KDM4E | |
| SCHEMBL29746420 | 0.84 | TSHR (0.44) | TSHRMYCALDH1A1HSD17B10LMNA | |
| SCHEMBL11664822 | 0.77 | DAPK3 (0.46) | TSHRMYCALDH1A1KDM4EKMT2A | |
| SCHEMBL31190966 | 0.77 | KDM4E (0.53) | TSHRMYCALDH1A1HSD17B10KDM4E | |
| SCHEMBL28698727 | 0.77 | TSHR (0.45) | TSHRMYCALDH1A1HSD17B10CLCN2 | |
| SCHEMBL19923193 | 0.75 | TSHR (0.68) | TSHRMYCALDH1A1HSD17B10KDM4E | |
| SCHEMBL11622444 | 0.75 | SLC6A3 (0.51) | TSHRMYCALDH1A1HSD17B10KDM4E | |
| SCHEMBL17965678 | 0.74 | MYC (0.61) | TSHRMYCALDH1A1HSD17B10KDM4E | |
| SCHEMBL29746440 | 0.73 | TSHR (0.41) | TSHRMYCALDH1A1HSD17B10KDM4E | |
| SCHEMBL23877806 | 0.72 | HMGB1 (0.41) | MYCALDH1A1HSD17B10KDM4EHPGD |
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-114072405-A | Heterocyclic monoacylglycerol lipase (MAGL) inhibitors | 豪夫迈·罗氏有限公司 | 2022-02-18 | — | — | CN | disclosed |