Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 1/20 | 0.56 |
| ▸ | HPGD | P15428 | 2/20 | 0.55 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.55 |
| ▸ | GAA | P10253 | 1/20 | 0.55 |
| ▸ | HTR6 | P50406 | 3/20 | 0.54 |
| ▸ | HTR7 | P34969 | 2/20 | 0.54 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.54 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.54 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.54 |
| ▸ | HTR2B | P41595 | 1/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.53 |
| ▸ | THRB | P10828 | 1/20 | 0.53 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.53 |
| ▸ | AHR | P35869 | 1/20 | 0.52 |
| ▸ | MAPT | P10636 | 2/20 | 0.51 |
| ▸ | IDO1 | P14902 | 1/20 | 0.49 |
| ▸ | HTR1B | P28222 | 1/20 | 0.49 |
| ▸ | HTR2A | P28223 | 1/20 | 0.49 |
| ▸ | HTR2C | P28335 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL9843379 | 1.00 | LMNA (0.56) | LMNAHPGDCYP1A2GAAHTR6 | |
| SCHEMBL3632803 | 0.84 | LMNA (0.53) | LMNAHPGDCYP1A2GAAHTR6 | |
| Hydrochloric Acid SCHEMBL21724904 | 0.84 | SIRT1 (0.45) | LMNAHPGDCYP1A2GAAHTR6 | |
| SCHEMBL8288846 | 0.83 | TP53 (0.56) | LMNAHPGDCYP1A2GAAHTR6 | |
| SCHEMBL21980641 | 0.82 | LMNA (0.55) | LMNAHPGDCYP1A2GAAHTR6 | |
| SCHEMBL1757618 | 0.80 | LMNA (0.53) | LMNAHPGDCYP1A2GAAHTR6 | |
| SCHEMBL13997300 | 0.80 | SIRT1 (0.54) | LMNAHPGDCYP1A2GAAHTR6 | |
| SCHEMBL13174592 | 0.78 | ALDH1A1 (0.56) | LMNAHPGDGAAALDH1A1KDM4E | |
| SCHEMBL30547023 | 0.78 | ALDH1A1 (0.56) | LMNAHPGDGAAALDH1A1KDM4E | |
| SCHEMBL16688229 | 0.78 | KDM4E (0.57) | LMNAHPGDALDH1A1KDM4ETHRB |
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-116730814-A | Novel naphthoquinone intermediate, preparation method thereof, chiral naphthalene compound and preparation method thereof | 香港科技大学深圳研究院 | 2023-09-12 | — | — | CN | disclosed |