Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 2/20 | 0.60 |
| ▸ | TSHR | P16473 | 2/20 | 0.60 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | MRGPRX4 | Q96LA9 | 6/20 | 0.47 |
| ▸ | LCLAT1 | Q6UWP7 | 2/20 | 0.46 |
| ▸ | CA1 | P00915 | 1/20 | 0.46 |
| ▸ | CA2 | P00918 | 1/20 | 0.46 |
| ▸ | PTGER1 | P34995 | 1/20 | 0.46 |
| ▸ | HTR2A | P28223 | 2/20 | 0.45 |
| ▸ | HTR2C | P28335 | 2/20 | 0.45 |
| ▸ | HTR2B | P41595 | 2/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | CASP1 | P29466 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.42 |
| ▸ | MYC | P01106 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL20522092 | 1.00 | GAA (0.60) | GAATSHRALDH1A1TP53MRGPRX4 | |
| SCHEMBL20522192 | 0.83 | PKM (0.46) | GAATSHRALDH1A1MRGPRX4LCLAT1 | |
| SCHEMBL20521955 | 0.82 | TSHR (0.65) | GAATSHRALDH1A1TP53MRGPRX4 | |
| SCHEMBL31497167 | 0.82 | TSHR (0.65) | GAATSHRALDH1A1TP53MRGPRX4 | |
| SCHEMBL16448844 | 0.81 | ABCB1 (0.48) | GAATSHRMRGPRX4LCLAT1PTGDR2 | |
| SCHEMBL1505175 | 0.81 | GAA (0.56) | GAATSHRALDH1A1TP53MRGPRX4 | |
| SCHEMBL1505174 | 0.81 | GAA (0.56) | GAATSHRALDH1A1TP53MRGPRX4 | |
| SCHEMBL31497228 | 0.79 | GAA (0.61) | GAATSHRALDH1A1TP53MRGPRX4 | |
| SCHEMBL987385 | 0.79 | GAA (0.61) | GAATSHRALDH1A1TP53MRGPRX4 | |
| SCHEMBL29488334 | 0.79 | TSHR (0.53) | GAATSHRALDH1A1TP53MRGPRX4 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-120136858-A | Compounds useful as ALCAT1 inhibitors | 中美博瑞纳制药有限公司 | 2025-06-13 | — | — | CN | disclosed |
| CN-110709394-B | Compounds useful as ALCAT1 inhibitors | 中美博瑞纳制药有限公司 | 2025-02-21 | — | — | CN | disclosed |