Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.43 |
| ▸ | TXNRD1 | Q16881 | 1/20 | 0.43 |
| ▸ | TXNRD3 | Q86VQ6 | 1/20 | 0.43 |
| ▸ | TXNRD2 | Q9NNW7 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | HTR2A | P28223 | 1/20 | 0.33 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.32 |
| ▸ | SIRT6 | Q8N6T7 | 1/20 | 0.32 |
| ▸ | VCAM1 | P19320 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL19030293 | 0.77 | VCAM1 (0.43) | ALDH1A1CYP3A4HPGDALOX15TSHR | |
| SCHEMBL29153758 | 0.73 | MEN1 (0.37) | ALDH1A1TDP1MEN1KMT2APKM | |
| SCHEMBL10580482 | 0.72 | ALDH1A1 (0.40) | ALDH1A1CYP3A4HPGDALOX15TSHR | |
| SCHEMBL29835896 | 0.71 | CYP1A2 (0.35) | ALDH1A1CYP3A4HPGDALOX15TSHR | |
| SCHEMBL19030214 | 0.70 | CYP1A2 (0.42) | ALDH1A1CYP3A4TSHRMEN1KMT2A | |
| SCHEMBL21634428 | 0.70 | MEN1 (0.39) | ALDH1A1CYP3A4MEN1KMT2ACYP1A2 | |
| SCHEMBL21326683 | 0.69 | LMNA (0.36) | ALDH1A1CYP3A4TSHRHIF1ATDP1 | |
| SCHEMBL29774018 | 0.69 | LMNA (0.36) | ALDH1A1CYP3A4TSHRHIF1ATDP1 | |
| SCHEMBL19030196 | 0.68 | GPR35 (0.39) | ALDH1A1CYP3A4HPGDALOX15TSHR | |
| SCHEMBL10493784 | 0.67 | ALDH1A1 (0.54) | ALDH1A1CYP3A4HPGDALOX15TSHR |
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-117510497-A | DGK zeta inhibitors | 山东轩竹医药科技有限公司 | 2024-02-06 | — | — | CN | disclosed |