Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | MCOLN3 | Q8TDD5 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | PSEN1 | P49768 | 1/20 | 0.39 |
| ▸ | PSEN2 | P49810 | 1/20 | 0.39 |
| ▸ | APH1B | Q8WW43 | 1/20 | 0.39 |
| ▸ | NCSTN | Q92542 | 1/20 | 0.39 |
| ▸ | APH1A | Q96BI3 | 1/20 | 0.39 |
| ▸ | PSENEN | Q9NZ42 | 1/20 | 0.39 |
| ▸ | ERN1 | O75460 | 2/20 | 0.38 |
| ▸ | NCEH1 | Q6PIU2 | 3/20 | 0.37 |
| ▸ | SMPD2 | O60906 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL9008021 | 0.78 | NCEH1 (0.49) | MAPTALDH1A1KDM4EHPGDCYP1A2 | |
| SCHEMBL27749330 | 0.76 | NCEH1 (0.48) | MAPTALDH1A1KDM4EHPGDCYP1A2 | |
| SCHEMBL1407222 | 0.76 | MEN1 (0.55) | TSHRMAPTALDH1A1LMNAKDM4E | |
| SCHEMBL4822278 | 0.76 | ERN1 (0.46) | TSHRALDH1A1LMNAKDM4EHPGD | |
| D-Alanine SCHEMBL3237942 | 0.75 | ELANE (0.41) | MAPTALDH1A1LMNAKDM4EHPGD | |
| Hydrochloric Acid SCHEMBL27640202 | 0.75 | NCEH1 (0.47) | MAPTALDH1A1KDM4EHPGDCYP1A2 | |
| Hydrochloric Acid SCHEMBL7536478 | 0.74 | MEN1 (0.53) | ALDH1A1KDM4EHPGDCYP1A2CYP2C19 | |
| SCHEMBL7536474 | 0.74 | ERN1 (0.44) | TSHRALDH1A1LMNAKDM4EHPGD | |
| SCHEMBL31497571 | 0.74 | NCEH1 (0.55) | MAPTALDH1A1LMNAKDM4EHPGD | |
| SCHEMBL7193527 | 0.72 | MMP3 (0.50) | ERN1ABCG2 |
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-119371331-A | Dual chiral element anti-rotation aryl tertiary amide compound, preparation method and application | 安徽中医药大学 | 2025-01-28 | — | — | CN | disclosed |