Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.54 |
| ▸ | HTT | P42858 | 3/20 | 0.54 |
| ▸ | LMNA | P02545 | 3/20 | 0.54 |
| ▸ | NPC1 | O15118 | 3/20 | 0.54 |
| ▸ | TP53 | P04637 | 3/20 | 0.54 |
| ▸ | MAPT | P10636 | 3/20 | 0.54 |
| ▸ | RAB9A | P51151 | 3/20 | 0.54 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.54 |
| ▸ | MEN1 | O00255 | 2/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.54 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.54 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.54 |
| ▸ | MPI | P34949 | 1/20 | 0.54 |
| ▸ | HKDC1 | Q2TB90 | 1/20 | 0.54 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.54 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.54 |
| ▸ | HPGD | P15428 | 5/20 | 0.53 |
| ▸ | GAA | P10253 | 4/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL29015145 | 1.00 | ALDH1A1 (0.54) | ALDH1A1KDM4EHTTLMNANPC1 | |
| SCHEMBL29015139 | 0.89 | TSHR (0.53) | ALDH1A1KDM4EHTTLMNANPC1 | |
| SCHEMBL29865007 | 0.89 | TSHR (0.53) | ALDH1A1KDM4EHTTLMNANPC1 | |
| SCHEMBL29015141 | 0.88 | TSHR (0.56) | ALDH1A1KDM4EHTTLMNANPC1 | |
| SCHEMBL14007356 | 0.88 | ALDH1A1 (0.56) | ALDH1A1KDM4EHTTLMNANPC1 | |
| SCHEMBL29865130 | 0.86 | TSHR (0.51) | ALDH1A1KDM4ELMNANPC1MAPT | |
| SCHEMBL29015146 | 0.86 | TSHR (0.51) | ALDH1A1KDM4ELMNANPC1MAPT | |
| SCHEMBL5154594 | 0.84 | ALDH1A1 (0.61) | ALDH1A1KDM4EHTTLMNANPC1 | |
| SCHEMBL29015142 | 0.84 | MAOB (0.47) | ALDH1A1KDM4EHTTLMNANPC1 | |
| SCHEMBL29864809 | 0.84 | MAOB (0.47) | ALDH1A1KDM4EHTTLMNANPC1 |
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-115057776-A | Synthesis method of 2-ethyl naphthoate derivative | 必维申瓯质量技术服务温州有限公司 | 2022-09-16 | — | — | CN | disclosed |