Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 1/20 | 0.55 |
| ▸ | TDO2 | P48775 | 1/20 | 0.55 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 1/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.50 |
| ▸ | CNR2 | P34972 | 1/20 | 0.50 |
| ▸ | DRD2 | P14416 | 1/20 | 0.50 |
| ▸ | DRD1 | P21728 | 1/20 | 0.50 |
| ▸ | CA1 | P00915 | 2/20 | 0.48 |
| ▸ | CA2 | P00918 | 2/20 | 0.48 |
| ▸ | CA12 | O43570 | 1/20 | 0.48 |
| ▸ | CA4 | P22748 | 1/20 | 0.48 |
| ▸ | CA7 | P43166 | 1/20 | 0.48 |
| ▸ | CA9 | Q16790 | 1/20 | 0.48 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.48 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.47 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.47 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.47 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL30273872 | 1.00 | IDO1 (0.55) | IDO1TDO2MEN1MAPTCYP2C9 | |
| SCHEMBL3862578 | 1.00 | IDO1 (0.55) | IDO1TDO2MEN1MAPTCYP2C9 | |
| SCHEMBL477540 | 1.00 | IDO1 (0.55) | IDO1TDO2MEN1MAPTCYP2C9 | |
| SCHEMBL30986735 | 1.00 | IDO1 (0.55) | IDO1TDO2MEN1MAPTCYP2C9 | |
| SCHEMBL19354894 | 0.87 | CYP2D6 (0.52) | IDO1TDO2MEN1MAPTCYP2C9 | |
| SCHEMBL29105289 | 0.87 | MAPT (0.51) | IDO1TDO2MEN1MAPTCYP2C9 | |
| SCHEMBL238441 | 0.87 | CA1 (0.57) | IDO1TDO2MAPTCA1CA2 | |
| SCHEMBL11420530 | 0.86 | BRD4 (0.48) | IDO1TDO2CNR2DRD2DRD1 | |
| SCHEMBL1584616 | 0.86 | CHRM2 (0.44) | IDO1TDO2KMT2ADRD2DRD1 | |
| SCHEMBL1682166 | 0.86 | MEN1 (0.48) | MEN1KMT2ACHRM2CHRM4CHRM5 |
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-116354802-A | Preparation method of chiral benzyl secondary alcohol compound | 上海毕得医药科技股份有限公司 | 2023-06-30 | — | — | CN | disclosed |