Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NQO2 | P16083 | 4/20 | 0.65 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.63 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.63 |
| ▸ | TUBB1 | Q9H4B7 | 1/20 | 0.58 |
| ▸ | MAPT | P10636 | 4/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.58 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.58 |
| ▸ | HPGD | P15428 | 2/20 | 0.58 |
| ▸ | MAOA | P21397 | 2/20 | 0.56 |
| ▸ | MAOB | P27338 | 2/20 | 0.56 |
| ▸ | RAB9A | P51151 | 3/20 | 0.56 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.56 |
| ▸ | MEN1 | O00255 | 1/20 | 0.56 |
| ▸ | LMNA | P02545 | 1/20 | 0.56 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.56 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.56 |
| ▸ | ESR1 | P03372 | 1/20 | 0.52 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.52 |
| ▸ | NPC1 | O15118 | 2/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL9789516 | 1.00 | NQO2 (0.65) | NQO2PTGS1PTGS2TUBB1MAPT | |
| SCHEMBL31474400 | 0.91 | NQO2 (0.76) | NQO2PTGS1PTGS2TUBB1MAPT | |
| SCHEMBL22383911 | 0.91 | NQO2 (0.76) | NQO2PTGS1PTGS2TUBB1MAPT | |
| SCHEMBL20457122 | 0.91 | NQO2 (0.76) | NQO2PTGS1PTGS2TUBB1MAPT | |
| SCHEMBL15477961 | 0.87 | ESR1 (0.65) | NQO2PTGS1PTGS2MAPTKDM4E | |
| SCHEMBL5950262 | 0.87 | ESR1 (0.65) | NQO2PTGS1PTGS2MAPTKDM4E | |
| SCHEMBL9465510 | 0.84 | PTGS1 (0.75) | NQO2PTGS1PTGS2TUBB1MAPT | |
| SCHEMBL9465277 | 0.84 | PTGS1 (0.75) | NQO2PTGS1PTGS2TUBB1MAPT | |
| SCHEMBL9465505 | 0.84 | PTGS1 (0.75) | NQO2PTGS1PTGS2TUBB1MAPT | |
| SCHEMBL9465281 | 0.84 | PTGS1 (0.75) | NQO2PTGS1PTGS2TUBB1MAPT |
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 |
|---|---|---|---|---|---|---|---|
| US-5015417-A | Electrooptical apparatus, liquid crystals, modulators | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1991-05-14 | — | — | US | disclosed |