Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 3/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | DHODH | Q02127 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | CDC7 | O00311 | 3/20 | 0.40 |
| ▸ | DBF4 | Q9UBU7 | 3/20 | 0.40 |
| ▸ | TRPM8 | Q7Z2W7 | 2/20 | 0.40 |
| ▸ | CA12 | O43570 | 1/20 | 0.40 |
| ▸ | CA1 | P00915 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | CA9 | Q16790 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL2692004 | 0.86 | ALDH1A1 (0.50) | ALDH1A1HSD17B10CYP1A2HPGDLMNA | |
| SCHEMBL2719635 | 0.86 | NPC1 (0.49) | ALDH1A1HSD17B10CYP1A2HPGDLMNA | |
| SCHEMBL1921091 | 0.85 | ALDH1A1 (0.49) | ALDH1A1HSD17B10CYP1A2HPGDLMNA | |
| SCHEMBL23214292 | 0.85 | LMNA (0.49) | ALDH1A1HSD17B10CYP1A2HPGDLMNA | |
| SCHEMBL2885576 | 0.84 | ALDH1A1 (0.47) | ALDH1A1HSD17B10CYP1A2HPGDLMNA | |
| SCHEMBL2823911 | 0.83 | ALDH1A1 (0.48) | ALDH1A1HSD17B10CYP1A2HPGDLMNA | |
| SCHEMBL2720641 | 0.83 | ALDH1A1 (0.63) | ALDH1A1HSD17B10CYP1A2HPGDLMNA | |
| SCHEMBL15581984 | 0.83 | ALDH1A1 (0.46) | ALDH1A1HSD17B10CYP1A2HPGDLMNA | |
| SCHEMBL2720481 | 0.83 | ALDH1A1 (0.46) | ALDH1A1HSD17B10CYP1A2HPGDLMNA | |
| SCHEMBL5552417 | 0.83 | ALDH1A1 (0.46) | ALDH1A1HSD17B10CYP1A2HPGDLMNA |
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-117229281-A | Di-parallel ring derivative regulator, preparation method and application thereof | 上海翰森生物医药科技有限公司 | 2023-12-15 | — | — | CN | disclosed |