Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 4/20 | 0.54 |
| ▸ | NPC1 | O15118 | 4/20 | 0.54 |
| ▸ | MEN1 | O00255 | 3/20 | 0.54 |
| ▸ | RGS12 | O14924 | 1/20 | 0.53 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.53 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.49 |
| ▸ | PTK2 | Q05397 | 1/20 | 0.49 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.49 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.49 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.49 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.49 |
| ▸ | PDE6D | O43924 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | MAPT | P10636 | 3/20 | 0.46 |
| ▸ | HPGD | P15428 | 2/20 | 0.46 |
| ▸ | ABL1 | P00519 | 1/20 | 0.45 |
| ▸ | RIN1 | Q13671 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 3/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL29020537 | 0.87 | MEN1 (0.56) | KMT2ANPC1MEN1SMN1; SMN2PDE6D | |
| SCHEMBL29020524 | 0.80 | NPC1 (0.58) | KMT2ANPC1MEN1RGS12ADRB2 | |
| SCHEMBL29020552 | 0.79 | NPC1 (0.56) | KMT2ANPC1MEN1RGS12ADRB2 | |
| SCHEMBL29020540 | 0.78 | RGS12 (0.52) | KMT2ANPC1MEN1RGS12ADRB2 | |
| SCHEMBL29020522 | 0.77 | MAPT (0.64) | KMT2ANPC1MEN1RGS12ADRB2 | |
| SCHEMBL30498865 | 0.76 | KMT2A (0.52) | KMT2ANPC1MEN1RGS12ADRB2 | |
| SCHEMBL29020553 | 0.75 | MEN1 (0.58) | KMT2ANPC1MEN1SMN1; SMN2ALDH1A1 | |
| SCHEMBL472280 | 0.71 | ALDH1A1 (0.58) | KMT2ANPC1HDAC3HDAC1HDAC2 | |
| SCHEMBL4206360 | 0.71 | HDAC2 (0.58) | KMT2ANPC1MEN1HDAC2SMN1; SMN2 | |
| SCHEMBL4197148 | 0.71 | NPC1 (0.81) | KMT2ANPC1MEN1SMN1; SMN2MAPT |
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 |