Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 5/20 | 0.44 |
| ▸ | TP53 | P04637 | 3/20 | 0.44 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | BRD4 | O60885 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 2/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | STAT1 | P42224 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL7453636 | 0.93 | PTGS2 (0.45) | PTGS2MAPTTP53PTGS1POLB | |
| SCHEMBL7450164 | 0.88 | PTGS2 (0.46) | PTGS2MAPTPTGS1LMNAALDH1A1 | |
| SCHEMBL7459052 | 0.86 | PTGS2 (0.44) | PTGS2MAPTPTGS1LMNAALDH1A1 | |
| SCHEMBL7455285 | 0.86 | PTGS1 (0.48) | PTGS2MAPTPTGS1POLBLMNA | |
| SCHEMBL7456757 | 0.85 | PTGS2 (0.50) | PTGS2MAPTPTGS1LMNABRD4 | |
| SCHEMBL7458524 | 0.83 | PTGS1 (0.41) | PTGS2MAPTPTGS1POLBTSHR | |
| SCHEMBL7458144 | 0.83 | PTGS2 (0.41) | PTGS2MAPTPTGS1LMNASMN1; SMN2 | |
| SCHEMBL7450436 | 0.83 | PTGS2 (0.41) | PTGS2MAPTPTGS1LMNAALDH1A1 | |
| SCHEMBL7451498 | 0.83 | PTGS2 (0.41) | PTGS2MAPTPTGS1POLBLMNA | |
| SCHEMBL7450672 | 0.83 | PTGS2 (0.41) | PTGS2MAPTPTGS1LMNAALDH1A1 |
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-2002081474-A1 | TRIAZOLOPHTHALAZINE / QUINOLINE / ISOQUINOLINE DERIVATIVES WHICH ARE LIGANDS FOR GABA-A RECEPTORS CONTAINING THE ALPHA 5 SUBTYPE | MERCK SHARP & DOHME LIMITED (GB) | 2002-10-17 | — | — | WO | disclosed |