Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP8 | P22894 | 2/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | RECQL | P46063 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.41 |
| ▸ | CASR | P41180 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 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 | |
|---|---|---|---|---|
| SCHEMBL30601599 | 1.00 | MMP8 (0.48) | MMP8SMN1; SMN2ALDH1A1TSHRKDM4E | |
| SCHEMBL29130527 | 0.96 | MMP8 (0.51) | MMP8SMN1; SMN2ALDH1A1TSHRKDM4E | |
| SCHEMBL30601600 | 0.88 | KMT2A (0.49) | SMN1; SMN2ALDH1A1TSHRLMNAMEN1 | |
| SCHEMBL29130537 | 0.88 | KMT2A (0.49) | SMN1; SMN2ALDH1A1TSHRLMNAMEN1 | |
| SCHEMBL280062 | 0.85 | MMP8 (0.50) | MMP8SMN1; SMN2ALDH1A1KDM4ELMNA | |
| SCHEMBL28731165 | 0.85 | MMP8 (0.50) | MMP8SMN1; SMN2ALDH1A1KDM4ELMNA | |
| SCHEMBL29130535 | 0.83 | KMT2A (0.53) | SMN1; SMN2ALDH1A1TSHRLMNAMEN1 | |
| SCHEMBL28278094 | 0.83 | MMP8 (0.50) | MMP8SMN1; SMN2ALDH1A1TSHRKDM4E | |
| SCHEMBL30595396 | 0.81 | SMN1; SMN2 (0.52) | MMP8SMN1; SMN2ALDH1A1TSHRKDM4E | |
| SCHEMBL28555706 | 0.79 | TSHR (0.57) | MMP8SMN1; SMN2ALDH1A1TSHRMEN1 |
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-114349687-B | 3, 5-dicarboxylic ester-1, 4-dihydropyridine hydrogenation reagent, preparation method and application thereof | 中山奕安泰医药科技有限公司 | 2023-11-17 | — | — | CN | disclosed |