Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | TLR8 | Q9NR97 | 4/20 | 0.33 |
| ▸ | TLR7 | Q9NYK1 | 1/20 | 0.33 |
| ▸ | TOP2A | P11388 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | MGAT2 | Q10469 | 1/20 | 0.32 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.31 |
| ▸ | MPO | P05164 | 2/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.30 |
| ▸ | NPC1 | O15118 | 2/20 | 0.30 |
| ▸ | RAB9A | P51151 | 2/20 | 0.30 |
| ▸ | SLC9A1 | P19634 | 1/20 | 0.30 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.30 |
| ▸ | APOBEC3A | P31941 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL6531515 | 0.95 | TLR8 (0.38) | ALDH1A1POLBTLR8MGAT2SMN1; SMN2 | |
| SCHEMBL6527507 | 0.89 | L3MBTL1 (0.33) | ALDH1A1L3MBTL1 | |
| SCHEMBL5569537 | 0.82 | MGAT2 (0.37) | ALDH1A1POLBKMT2ATLR8TLR7 | |
| SCHEMBL2514304 | 0.81 | — | — | |
| SCHEMBL8855687 | 0.77 | MGAT2 (0.41) | ALDH1A1POLBTLR8MGAT2CYP19A1 | |
| SCHEMBL24309296 | 0.76 | MGAT2 (0.42) | ALDH1A1POLBL3MBTL1MGAT2CYP19A1 | |
| SCHEMBL294897 | 0.73 | ALDH1A1 (0.41) | ALDH1A1POLBKMT2ATLR8TLR7 | |
| SCHEMBL294896 | 0.72 | POLB (0.36) | ALDH1A1POLBKMT2ATLR8TLR7 | |
| SCHEMBL15648579 | 0.72 | ALDH1A1 (0.36) | ALDH1A1POLBKMT2ATLR8TLR7 | |
| SCHEMBL23402376 | 0.72 | ALDH1A1 (0.37) | ALDH1A1POLBKMT2ATLR8TLR7 |
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 |