Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.57 |
| ▸ | NPC1 | O15118 | 3/20 | 0.57 |
| ▸ | MEN1 | O00255 | 2/20 | 0.57 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.55 |
| ▸ | RGS12 | O14924 | 1/20 | 0.53 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.53 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.49 |
| ▸ | PTK2 | Q05397 | 2/20 | 0.49 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.49 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.49 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.49 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 2/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL29020552 | 0.87 | NPC1 (0.56) | KMT2ANPC1MEN1SMN1; SMN2RGS12 | |
| SCHEMBL4212730 | 0.84 | KDM4E (0.64) | KMT2ANPC1MEN1SMN1; SMN2RGS12 | |
| SCHEMBL11509618 | 0.83 | NPC1 (0.76) | KMT2ANPC1MEN1SMN1; SMN2RGS12 | |
| SCHEMBL29020532 | 0.81 | GAA (0.41) | KMT2ANPC1MEN1SMN1; SMN2RGS12 | |
| SCHEMBL29020529 | 0.81 | MEN1 (0.62) | KMT2ANPC1MEN1SMN1; SMN2KDM4E | |
| SCHEMBL29020536 | 0.77 | MAPT (0.39) | KMT2AMEN1SMN1; SMN2ADRB2KDM4E | |
| SCHEMBL4202140 | 0.73 | KMT2A (0.76) | KMT2ANPC1MEN1SMN1; SMN2RGS12 | |
| SCHEMBL4197148 | 0.73 | NPC1 (0.81) | KMT2ANPC1MEN1SMN1; SMN2RAB9A | |
| SCHEMBL6408038 | 0.73 | NPC1 (1.00) | KMT2ANPC1MEN1SMN1; SMN2RGS12 | |
| SCHEMBL29020542 | 0.72 | MEN1 (0.59) | KMT2ANPC1MEN1SMN1; SMN2KDM4E |
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-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 |