Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 11/20 | 0.44 |
| ▸ | HDAC6 | Q9UBN7 | 6/20 | 0.44 |
| ▸ | HDAC2 | Q92769 | 4/20 | 0.44 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.44 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.44 |
| ▸ | HDAC5 | Q9UQL6 | 2/20 | 0.44 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | HDAC9 | Q9UKV0 | 3/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.37 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.37 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.37 |
| ▸ | HDAC8 | Q9BY41 | 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 | |
|---|---|---|---|---|
| SCHEMBL10382984 | 0.77 | HDAC6 (0.40) | HDAC1HDAC6HDAC2HDAC3HDAC4 | |
| SCHEMBL10383421 | 0.74 | HDAC1 (0.39) | HDAC1HDAC6HDAC2HDAC3HDAC4 | |
| SCHEMBL10384782 | 0.73 | OPRM1 (0.40) | HDAC1HDAC6HDAC2HDAC3HDAC4 | |
| SCHEMBL11405556 | 0.73 | CYP2D6 (0.41) | HDAC1HDAC6HDAC2HDAC3HDAC4 | |
| SCHEMBL10600686 | 0.73 | CYP2D6 (0.41) | HDAC1HDAC6HDAC2HDAC3HDAC4 | |
| SCHEMBL11380275 | 0.73 | ALDH1A1 (0.41) | HDAC1HDAC6HDAC2HDAC3HDAC4 | |
| SCHEMBL3226743 | 0.73 | KCNH2 (0.49) | HDAC1HDAC6HDAC2HDAC3HDAC4 | |
| SCHEMBL9812726 | 0.71 | KCNH2 (0.47) | HDAC1HDAC6HDAC2HDAC3HDAC4 | |
| SCHEMBL29174424 | 0.71 | CYP2D6 (0.61) | HDAC1HDAC6HDAC2HDAC3HDAC4 | |
| SCHEMBL13739154 | 0.71 | CYP2D6 (0.61) | HDAC1HDAC6HDAC2HDAC3HDAC4 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4946959-A | Method of preparing 5-alkyl-1-(2-pyridinyl)-1H-1,2,4-triazol-3-ols | THE DOW CHEMICAL COMPANY (US) | 1990-08-07 | — | — | US | disclosed |
| US-4946959-A | Method of preparing 5-alkyl-1-(2-pyridinyl)-1H-1,2,4-triazol-3-ols | THE DOW CHEMICAL COMPANY (US) | 1990-08-07 | — | — | US | disclosed |
| US-4681943-A | 1-acyl-1-(2-pyridinyl)semicarbazides | THE DOW CHEMICAL COMPANY (US) | 1987-07-21 | — | — | US | disclosed |
| US-4681943-A | 1-acyl-1-(2-pyridinyl)semicarbazides | THE DOW CHEMICAL COMPANY (US) | 1987-07-21 | — | — | US | disclosed |
| US-4681943-A | 1-acyl-1-(2-pyridinyl)semicarbazides | THE DOW CHEMICAL COMPANY (US) | 1987-07-21 | — | — | US | disclosed |