Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 2/20 | 0.53 |
| ▸ | RPA1 | P27694 | 1/20 | 0.52 |
| ▸ | MARS1 | P56192 | 6/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | CNR2 | P34972 | 1/20 | 0.43 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.43 |
| ▸ | SMPD1 | P17405 | 1/20 | 0.42 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.42 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | HTT | P42858 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | CASP1 | P29466 | 1/20 | 0.41 |
| ▸ | CNR1 | P21554 | 1/20 | 0.41 |
| ▸ | MYC | P01106 | 1/20 | 0.40 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL4172241 | 0.84 | ALDH1A1 (0.52) | MARS1ALDH1A1NOTUMSMN1; SMN2MEN1 | |
| SCHEMBL28763473 | 0.82 | AR (0.40) | LMNARPA1MARS1ALDH1A1SMN1; SMN2 | |
| SCHEMBL29253920 | 0.80 | RPA1 (0.60) | LMNARPA1MARS1ALDH1A1CNR2 | |
| SCHEMBL10468509 | 0.79 | LMNA (0.52) | LMNARPA1MARS1ALDH1A1NOTUM | |
| SCHEMBL28961018 | 0.78 | KMT2A (0.59) | LMNAALDH1A1NOTUMSMN1; SMN2HTT | |
| SCHEMBL30863651 | 0.77 | SMN1; SMN2 (0.54) | RPA1ALDH1A1SMPD1SMN1; SMN2MEN1 | |
| SCHEMBL29920957 | 0.75 | L3MBTL1 (0.35) | LMNARPA1MARS1MEN1MAPT | |
| SCHEMBL1198603 | 0.75 | L3MBTL1 (0.35) | LMNARPA1MARS1MEN1MAPT | |
| SCHEMBL14996548 | 0.75 | LMNA (0.48) | LMNARPA1CNR2CNR1 | |
| SCHEMBL30070446 | 0.74 | LMNA (0.44) | LMNAALDH1A1SMN1; SMN2MEN1MAPT |
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-116730977-A | Novel aryl heterocyclic compound, and preparation method and application thereof | 华东理工大学 | 2023-09-12 | — | — | CN | disclosed |