Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.50 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | TP53 | P04637 | 2/20 | 0.44 |
| ▸ | FABP4 | P15090 | 1/20 | 0.43 |
| ▸ | TSPO | P30536 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 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 | |
|---|---|---|---|---|
| SCHEMBL2215283 | 0.92 | CYP19A1 (0.49) | MEN1TSHRKMT2AKDM4EALDH1A1 | |
| SCHEMBL29217034 | 0.90 | CCR2 (0.50) | MEN1TSHRKMT2ALMNAKDM4E | |
| SCHEMBL29217013 | 0.87 | MEN1 (0.48) | MEN1TSHRKMT2ALMNAKDM4E | |
| SCHEMBL27899797 | 0.86 | MCL1 (0.49) | MEN1TSHRKMT2ALMNAMCL1 | |
| SCHEMBL2216044 | 0.85 | ALDH1A1 (0.42) | MEN1TSHRKMT2AKDM4EALDH1A1 | |
| SCHEMBL29217032 | 0.84 | MEN1 (0.42) | MEN1TSHRKMT2ALMNAMCL1 | |
| SCHEMBL2216231 | 0.82 | PTGER4 (0.54) | MEN1TSHRKMT2ALMNAKDM4E | |
| SCHEMBL27917587 | 0.82 | MDM4 (0.50) | MEN1TSHRKMT2ALMNAKDM4E | |
| SCHEMBL30583114 | 0.81 | LMNA (0.57) | MEN1TSHRKMT2ALMNAKDM4E | |
| SCHEMBL2214591 | 0.80 | GAA (0.50) | TSHRLMNAKDM4EALDH1A1GAA |
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 |