Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 3/20 | 0.54 |
| ▸ | HPGD | P15428 | 1/20 | 0.53 |
| ▸ | BACE1 | P56817 | 2/20 | 0.49 |
| ▸ | GBA1 | P04062 | 1/20 | 0.48 |
| ▸ | CA12 | O43570 | 2/20 | 0.48 |
| ▸ | CA1 | P00915 | 2/20 | 0.48 |
| ▸ | CA2 | P00918 | 2/20 | 0.48 |
| ▸ | CA9 | Q16790 | 2/20 | 0.48 |
| ▸ | RORC | P51449 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | GALR2 | O43603 | 1/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL14505112 | 0.91 | PTGS2 (0.57) | PTGS2BACE1GBA1CA12CA1 | |
| SCHEMBL14503352 | 0.91 | PTGS2 (0.57) | PTGS2BACE1GBA1CA12CA1 | |
| SCHEMBL14503266 | 0.91 | PTGS2 (0.57) | PTGS2BACE1GBA1CA12CA1 | |
| SCHEMBL14503940 | 0.89 | PTGS2 (0.62) | PTGS2BACE1GBA1CA12CA1 | |
| SCHEMBL14505175 | 0.88 | PTGS2 (0.53) | PTGS2BACE1GBA1CA12CA1 | |
| SCHEMBL14503906 | 0.87 | GBA1 (0.56) | PTGS2BACE1GBA1CA12CA1 | |
| SCHEMBL14504953 | 0.86 | PTGS2 (0.61) | PTGS2HPGDBACE1CA12CA1 | |
| SCHEMBL5387073 | 0.85 | TSHR (0.41) | HPGDTSHRALDH1A1MEN1KMT2A | |
| SCHEMBL14504877 | 0.85 | PTGS2 (0.54) | PTGS2HPGDBACE1GBA1CA12 | |
| SCHEMBL14503891 | 0.83 | NPSR1 (0.64) | PTGS2BACE1GBA1CA12CA1 |
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 |