Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 2/20 | 0.56 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.54 |
| ▸ | POLB | P06746 | 1/20 | 0.54 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.54 |
| ▸ | TSHR | P16473 | 1/20 | 0.54 |
| ▸ | RORC | P51449 | 1/20 | 0.54 |
| ▸ | GBA1 | P04062 | 2/20 | 0.51 |
| ▸ | BACE1 | P56817 | 3/20 | 0.50 |
| ▸ | LMNA | P02545 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | CA12 | O43570 | 2/20 | 0.47 |
| ▸ | CA1 | P00915 | 2/20 | 0.47 |
| ▸ | CA2 | P00918 | 2/20 | 0.47 |
| ▸ | CA9 | Q16790 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL14503129 | 1.00 | PTGS2 (0.56) | PTGS2NPSR1POLBALOX15TSHR | |
| SCHEMBL14503176 | 0.90 | NPSR1 (0.48) | PTGS2NPSR1POLBALOX15TSHR | |
| SCHEMBL14503771 | 0.89 | NPSR1 (0.46) | PTGS2NPSR1POLBALOX15TSHR | |
| SCHEMBL14504877 | 0.88 | PTGS2 (0.54) | PTGS2NPSR1RORCGBA1BACE1 | |
| SCHEMBL14505104 | 0.88 | BACE1 (0.60) | PTGS2NPSR1POLBRORCBACE1 | |
| SCHEMBL14503891 | 0.86 | NPSR1 (0.64) | PTGS2NPSR1RORCGBA1BACE1 | |
| SCHEMBL14503940 | 0.86 | PTGS2 (0.62) | PTGS2NPSR1RORCGBA1BACE1 | |
| SCHEMBL14504987 | 0.85 | POLB (0.55) | PTGS2NPSR1POLBBACE1LMNA | |
| SCHEMBL14505112 | 0.85 | PTGS2 (0.57) | PTGS2NPSR1TSHRRORCGBA1 | |
| SCHEMBL5381360 | 0.85 | TSHR (0.47) | PTGS2NPSR1POLBALOX15TSHR |
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 |
|---|---|---|---|---|---|---|---|
| US-7223759-B2 | Antibacterial 3,5-diaminopiperidine-substituted aromatic and heteroaromatic compounds | ANADYS PHARMACEUTICALS, INC. (US) | 2007-05-29 | — | — | US | disclosed |
| US-7223759-B2 | Antibacterial 3,5-diaminopiperidine-substituted aromatic and heteroaromatic compounds | ANADYS PHARMACEUTICALS, INC. (US) | 2007-05-29 | — | — | US | disclosed |