Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TLR4 | O00206 | 2/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.30 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL9561964 | 1.00 | TLR4 (0.37) | TLR4CYP1A2CYP2C9ALDH1A1LMNA | |
| SCHEMBL9406314 | 0.93 | CYP1A2 (0.39) | TLR4CYP1A2CYP2C9ALDH1A1LMNA | |
| SCHEMBL9406311 | 0.93 | CYP1A2 (0.39) | TLR4CYP1A2CYP2C9ALDH1A1LMNA | |
| SCHEMBL9561920 | 0.90 | CYP1A2 (0.37) | CYP1A2CYP2C9ALDH1A1LMNAMAPT | |
| SCHEMBL9561918 | 0.90 | CYP1A2 (0.37) | CYP1A2CYP2C9ALDH1A1LMNAMAPT | |
| SCHEMBL5836344 | 0.87 | TLR4 (0.42) | TLR4CYP1A2CYP2C9ALDH1A1LMNA | |
| SCHEMBL5836340 | 0.87 | TLR4 (0.42) | TLR4CYP1A2CYP2C9ALDH1A1LMNA | |
| SCHEMBL6697654 | 0.87 | TLR4 (0.42) | TLR4CYP1A2CYP2C9ALDH1A1LMNA | |
| SCHEMBL9336580 | 0.86 | TLR4 (0.37) | TLR4CYP1A2CYP2C9ALDH1A1LMNA | |
| SCHEMBL9336574 | 0.86 | TLR4 (0.37) | TLR4CYP1A2CYP2C9ALDH1A1LMNA |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2955570-A1 | LIQUID CRYSTAL DISPLAY ELEMENT AND MANUFACTURING METHOD FOR SAME | DIC Corporation (JP) | 2015-12-16 | — | — | EP | disclosed |
| US-5262556-A | Alkylation or hydroxyalkylation by deprotonation | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1993-11-16 | — | — | US | disclosed |
| US-5236620-A | 2,3-DIFLUOROBENZENE DERIVATIVES | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1993-08-17 | — | — | US | disclosed |