Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | NAAA | Q02083 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL10707658 | 1.00 | CYP1A2 (0.45) | CYP1A2LMNAMAPK1HTTNAAA | |
| SCHEMBL10486154 | 1.00 | CYP1A2 (0.45) | CYP1A2LMNAMAPK1HTTNAAA | |
| SCHEMBL10703821 | 0.95 | CYP1A2 (0.39) | CYP1A2LMNAMAPK1HTTNAAA | |
| SCHEMBL10486361 | 0.95 | CYP1A2 (0.39) | CYP1A2LMNAMAPK1HTTNAAA | |
| SCHEMBL10486370 | 0.95 | CYP1A2 (0.39) | CYP1A2LMNAMAPK1HTTNAAA | |
| SCHEMBL10486180 | 0.95 | CYP1A2 (0.44) | CYP1A2LMNAMAPK1HTTNAAA | |
| SCHEMBL10703324 | 0.95 | CYP1A2 (0.44) | CYP1A2LMNAMAPK1HTTNAAA | |
| SCHEMBL10704837 | 0.95 | CYP1A2 (0.39) | CYP1A2LMNAMAPK1HTTNAAA | |
| SCHEMBL10702710 | 0.93 | CYP1A2 (0.42) | CYP1A2LMNAMAPK1HTTNAAA | |
| SCHEMBL10486340 | 0.93 | CYP1A2 (0.42) | CYP1A2LMNAMAPK1HTTNAAA |
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-4868341-A | LIQUID CRYSTALS | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1989-09-19 | — | — | US | disclosed |
| US-4622164-A | LIQUID CRYSTAL DIELECTRICS | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1986-11-11 | — | — | US | disclosed |