Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR6 | P50406 | 3/20 | 0.40 |
| ▸ | TYR | P14679 | 5/20 | 0.38 |
| ▸ | ACHE | P22303 | 1/20 | 0.38 |
| ▸ | PTGS2 | P35354 | 5/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 4/20 | 0.36 |
| ▸ | HTR1A | P08908 | 1/20 | 0.36 |
| ▸ | DRD3 | P35462 | 1/20 | 0.36 |
| ▸ | CA12 | O43570 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
| ▸ | RXRA | P19793 | 1/20 | 0.36 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.36 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL6527434 | 0.90 | TYR (0.39) | HTR6TYRACHEPTGS2ALOX15 | |
| SCHEMBL6925271 | 0.83 | TYR (0.38) | TYRACHEPTGS2ALOX15KCNH2 | |
| SCHEMBL6528269 | 0.79 | GRM1 (0.41) | TYRPTGS2ALOX15KCNH2HTR1A | |
| SCHEMBL6920471 | 0.72 | TYR (0.39) | TYRACHEPTGS2ALOX15DRD3 | |
| SCHEMBL5623713 | 0.72 | ALDH1A1 (0.45) | TYRALOX15RXRAGRIN1GRIN2B | |
| SCHEMBL19211452 | 0.69 | KCNH2 (0.59) | KCNH2RXRAGRIN1GRIN2B | |
| SCHEMBL6533967 | 0.68 | ADRA1D (0.42) | TYRPTGS2ALOX15 | |
| SCHEMBL6529962 | 0.67 | GRM5 (0.39) | TYRACHEDRD3 | |
| SCHEMBL22340606 | 0.67 | PDK2 (0.41) | HTR6HTR1ADRD3 | |
| SCHEMBL6532784 | 0.66 | RBP4 (0.41) | TYRPTGS2ALOX15KCNH2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2005082892-A2 | TRIAZOLE COMPOUNDS AS ANTIBACTERIAL AGENTS AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | DR. REDDY'S LABORATORIES LTD. (IN) | 2005-09-09 | — | — | WO | disclosed |