Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 2/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | TSPO | P30536 | 1/20 | 0.45 |
| ▸ | EDNRB | P24530 | 4/20 | 0.45 |
| ▸ | FABP4 | P15090 | 1/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | PKM | P14618 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | CNR2 | P34972 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.41 |
| ▸ | AGTR2 | P50052 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | MITF | O75030 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL29217022 | 0.86 | LMNA (0.49) | LMNAHTTL3MBTL1MEN1KMT2A | |
| SCHEMBL29217038 | 0.85 | ALDH1A1 (0.48) | LMNATSHRL3MBTL1MEN1KMT2A | |
| SCHEMBL29217027 | 0.85 | LMNA (0.39) | LMNATSHRHTTL3MBTL1TSPO | |
| SCHEMBL2214735 | 0.84 | CYP19A1 (0.47) | L3MBTL1MEN1KMT2ASMN1; SMN2GAA | |
| SCHEMBL29217023 | 0.84 | P2RX4 (0.50) | TSPOEDNRBFABP4MEN1KMT2A | |
| SCHEMBL29217035 | 0.83 | KIF11 (0.43) | FABP4GAAMAPTALDH1A1NPSR1 | |
| SCHEMBL2214060 | 0.82 | ALDH1A1 (0.48) | LMNATSHRHTTL3MBTL1ALOX15 | |
| SCHEMBL29217013 | 0.81 | MEN1 (0.48) | LMNATSHRL3MBTL1TSPOFABP4 | |
| SCHEMBL29217015 | 0.80 | CCR2 (0.48) | LMNATSHRTSPOALOX15MEN1 | |
| SCHEMBL29217042 | 0.80 | KDM4E (0.53) | LMNATSHRHTTFABP4MEN1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-118084903-A | Beta-carboline hydrogen sulfide donor derivative and preparation method and application thereof | 贵州医科大学 | 2024-05-28 | — | — | CN | claimed |
| CN-118084903-A | Beta-carboline hydrogen sulfide donor derivative and preparation method and application thereof | 贵州医科大学 | 2024-05-28 | — | — | CN | disclosed |