Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 4/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.38 |
| ▸ | SKP2 | Q13309 | 1/20 | 0.37 |
| ▸ | ESR1 | P03372 | 3/20 | 0.37 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.37 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.37 |
| ▸ | TACR2 | P21452 | 2/20 | 0.37 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.37 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.37 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL201550 | 0.91 | PTGS2 (0.49) | PTGS2NPC1HPGDMAPK1HTT | |
| SCHEMBL11803382 | 0.91 | PTGS2 (0.49) | PTGS2NPC1HPGDMAPK1HTT | |
| SCHEMBL11801309 | 0.88 | PTGS2 (0.53) | PTGS2NPC1HPGDMAPK1HTT | |
| SCHEMBL11796390 | 0.88 | PTGS2 (0.44) | PTGS2NPC1HPGDMAPK1HTT | |
| SCHEMBL11804423 | 0.88 | PTGS2 (0.53) | PTGS2NPC1HPGDMAPK1HTT | |
| SCHEMBL11798710 | 0.88 | PTGS2 (0.53) | PTGS2NPC1HPGDMAPK1HTT | |
| SCHEMBL199764 | 0.88 | PTGS2 (0.53) | PTGS2NPC1HPGDMAPK1HTT | |
| SCHEMBL11804313 | 0.88 | PTGS2 (0.53) | PTGS2NPC1HPGDMAPK1HTT | |
| SCHEMBL201729 | 0.88 | PTGS2 (0.53) | PTGS2NPC1HPGDMAPK1HTT | |
| SCHEMBL11333764 | 0.87 | GPR84 (0.37) | PTGS2CYP3A4GPR84ESR1 |
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 |
|---|---|---|---|---|---|---|---|
| JP-6166645-A | — | — | None | — | — | JP | disclosed |
| JP-H06166645-A | 2,4-DIALKYL-6-SEC-ALKYLPHENOL | CIBA GEIGY AG | 1994-06-14 | — | — | JP | disclosed |