Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | USP2 | O75604 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.38 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.38 |
| ▸ | APOBEC3A | P31941 | 1/20 | 0.38 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | HTT | P42858 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | RECQL | P46063 | 1/20 | 0.38 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | SSTR4 | P31391 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL29020525 | 0.85 | TSHR (0.51) | MAPTLMNAALDH1A1CYP3A4CYP2C19 | |
| SCHEMBL29020529 | 0.79 | MEN1 (0.62) | MAPTLMNAALDH1A1CYP3A4CYP2C19 | |
| SCHEMBL29020528 | 0.77 | KMT2A (0.57) | MAPTLMNAKDM4EADRB2SMN1; SMN2 | |
| SCHEMBL29020534 | 0.74 | CYP2C19 (0.50) | MAPTLMNAALDH1A1CYP3A4CYP2C19 | |
| SCHEMBL29020532 | 0.73 | GAA (0.41) | MAPTLMNAALDH1A1CYP3A4CYP2C19 | |
| SCHEMBL29020542 | 0.67 | MEN1 (0.59) | MAPTLMNAALDH1A1CYP3A4CYP2C19 | |
| SCHEMBL29020552 | 0.65 | NPC1 (0.56) | MAPTALDH1A1CYP2C19KDM4EADRB2 | |
| SCHEMBL421728 | 0.65 | SIGMAR1 (0.55) | ALDH1A1HTTMEN1KMT2A | |
| SCHEMBL29020558 | 0.63 | TSHR (0.79) | MAPTLMNAALDH1A1CYP3A4CYP2C19 | |
| SCHEMBL29020553 | 0.62 | MEN1 (0.58) | MAPTLMNAALDH1A1SMN1; SMN2MEN1 |
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 |