Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | ELANE | P08246 | 3/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | GSK3A | P49840 | 2/20 | 0.40 |
| ▸ | GSK3B | P49841 | 2/20 | 0.40 |
| ▸ | F2 | P00734 | 1/20 | 0.40 |
| ▸ | PLG | P00747 | 1/20 | 0.40 |
| ▸ | CTSG | P08311 | 1/20 | 0.40 |
| ▸ | CMA1 | P23946 | 1/20 | 0.40 |
| ▸ | CTRC | Q99895 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.38 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | PIM1 | P11309 | 2/20 | 0.38 |
| ▸ | MGLL | Q99685 | 1/20 | 0.38 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL7449986 | 0.77 | ELANE (0.50) | CYP2C19ELANEMEN1KMT2AALDH1A1 | |
| SCHEMBL14400476 | 0.72 | CYP2C19 (0.48) | CYP2C19ELANEMEN1KMT2AALDH1A1 | |
| SCHEMBL5534441 | 0.69 | DDB1 (0.41) | CYP2C19ELANEMEN1KMT2AALDH1A1 | |
| SCHEMBL6618744 | 0.68 | KMT2A (0.49) | CYP2C19MEN1KMT2AALDH1A1GSK3A | |
| SCHEMBL7928518 | 0.66 | CMA1 (0.53) | MEN1KMT2AALDH1A1GSK3AGSK3B | |
| SCHEMBL2246388 | 0.64 | GAA (0.51) | ELANEMEN1KMT2AALDH1A1GSK3A | |
| SCHEMBL7833789 | 0.64 | ELANE (0.71) | CYP2C19ELANEMEN1KMT2AALDH1A1 | |
| SCHEMBL29597582 | 0.64 | GAA (0.65) | CYP2C19ELANEMEN1KMT2AALDH1A1 | |
| SCHEMBL6551986 | 0.64 | HSD11B1 (0.48) | ELANEMEN1KMT2AALDH1A1F2 | |
| SCHEMBL17140600 | 0.64 | CCR5 (0.45) | CYP2C19ALDH1A1DDB1CRBN |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114315619-B | Synthesis method of dimethoxy dopa | 山东泓瑞医药科技股份公司 | 2023-03-24 | — | — | CN | claimed |
| CN-114315619-A | Synthetic method of 3- (3, 4-dimethoxyphenyl) -L-alanine | 山东泓瑞医药科技股份公司 | 2022-04-12 | — | — | CN | claimed |
| CN-114315619-B | Synthesis method of dimethoxy dopa | 山东泓瑞医药科技股份公司 | 2023-03-24 | — | — | CN | disclosed |
| CN-114315619-A | Synthetic method of 3- (3, 4-dimethoxyphenyl) -L-alanine | 山东泓瑞医药科技股份公司 | 2022-04-12 | — | — | CN | disclosed |