Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 5/20 | 0.75 |
| ▸ | LMNA | P02545 | 2/20 | 0.75 |
| ▸ | MEN1 | O00255 | 5/20 | 0.59 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.59 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.59 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.55 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.55 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.55 |
| ▸ | POLB | P06746 | 1/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.55 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.55 |
| ▸ | MAPT | P10636 | 2/20 | 0.50 |
| ▸ | PDE6D | O43924 | 1/20 | 0.49 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
| ▸ | HPGD | P15428 | 1/20 | 0.49 |
| ▸ | HTT | P42858 | 1/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.49 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL29020558 | 0.87 | TSHR (0.79) | TSHRLMNAMEN1KMT2ASMN1; SMN2 | |
| SCHEMBL30498866 | 0.85 | MEN1 (0.58) | TSHRLMNAMEN1KMT2ASMN1; SMN2 | |
| SCHEMBL29020542 | 0.84 | MEN1 (0.59) | TSHRLMNAMEN1KMT2ASMN1; SMN2 | |
| SCHEMBL29020522 | 0.84 | MAPT (0.64) | TSHRLMNAMEN1KMT2ASMN1; SMN2 | |
| SCHEMBL30498868 | 0.82 | MEN1 (0.56) | TSHRLMNAMEN1KMT2ASMN1; SMN2 | |
| SCHEMBL29020537 | 0.82 | MEN1 (0.56) | TSHRLMNAMEN1KMT2ASMN1; SMN2 | |
| SCHEMBL29020534 | 0.80 | CYP2C19 (0.50) | TSHRLMNAMEN1KMT2ASMN1; SMN2 | |
| SCHEMBL4208919 | 0.73 | TSHR (0.66) | TSHRLMNAMEN1KMT2ASMN1; SMN2 | |
| SCHEMBL4215113 | 0.73 | TSHR (0.76) | TSHRLMNAMEN1KMT2ASMN1; SMN2 | |
| SCHEMBL4209301 | 0.72 | TSHR (0.72) | TSHRLMNAMEN1KMT2ASMN1; SMN2 |
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-113402473-B | Thiotriazole compound, preparation method and application thereof | 四川省医学科学院·四川省人民医院 | 2023-06-23 | — | — | CN | disclosed |
| CN-113402473-A | Thiotriazole compound, preparation method and application thereof | 四川省医学科学院·四川省人民医院 | 2021-09-17 | — | — | CN | disclosed |