Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 5/20 | 0.47 |
| ▸ | TSHR | P16473 | 2/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.46 |
| ▸ | CA12 | O43570 | 1/20 | 0.46 |
| ▸ | CA1 | P00915 | 1/20 | 0.46 |
| ▸ | CA2 | P00918 | 1/20 | 0.46 |
| ▸ | CA4 | P22748 | 1/20 | 0.46 |
| ▸ | CA6 | P23280 | 1/20 | 0.46 |
| ▸ | CA7 | P43166 | 1/20 | 0.46 |
| ▸ | TPMT | P51580 | 1/20 | 0.46 |
| ▸ | CA9 | Q16790 | 1/20 | 0.46 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.46 |
| ▸ | SLC9A1 | P19634 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL1603755 | 0.84 | TSHR (0.62) | MAPTTSHRSMN1; SMN2ALDH1A1KDM4E | |
| Methyl Alcohol SCHEMBL28799088 | 0.82 | CA2 (0.52) | MAPTTSHRCYP1A2CYP2C9CYP2C19 | |
| SCHEMBL29419589 | 0.82 | CA2 (0.56) | MAPTTSHRCYP1A2CYP2C9CYP2C19 | |
| SCHEMBL20509 | 0.82 | CA2 (0.56) | MAPTTSHRCYP1A2CYP2C9CYP2C19 | |
| SCHEMBL2829108 | 0.82 | ALDH1A1 (0.44) | MAPTTSHRCYP1A2CYP2C9CYP2C19 | |
| SCHEMBL7364004 | 0.81 | ALDH1A1 (0.46) | MAPTTSHRCYP1A2CYP2C9CYP2C19 | |
| Acetic Acid SCHEMBL27710642 | 0.81 | CA12 (0.49) | MAPTTSHRCYP1A2CYP2C9CYP2C19 | |
| Formaldehyde SCHEMBL23581083 | 0.81 | CA2 (0.50) | MAPTTSHRCYP1A2CYP2C9CYP2C19 | |
| SCHEMBL1256865 | 0.80 | CA2 (0.54) | MAPTTSHRCYP1A2CYP2C9CYP2C19 | |
| SCHEMBL3325627 | 0.80 | TNFSF11 (0.55) | MAPTTSHRCYP1A2CYP2C9CYP2C19 |
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-110036014-B | Compound with AXL inhibitory activity and preparation and application thereof | 中国科学院上海药物研究所 | 2021-09-07 | — | — | CN | disclosed |
| CN-105884695-A | Heterocyclic derivate tyrosine kinase inhibitor | 山东轩竹医药科技有限公司 | 2016-08-24 | — | — | CN | disclosed |