Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | FAAH | O00519 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL9758639 | 1.00 | CYP1A2 (0.34) | CYP1A2FAAHLMNAMAPK1HTT | |
| SCHEMBL9758551 | 0.97 | CYP1A2 (0.34) | CYP1A2LMNAMAPK1HTT | |
| SCHEMBL9758964 | 0.97 | CYP1A2 (0.31) | CYP1A2FAAH | |
| SCHEMBL9758960 | 0.97 | CYP1A2 (0.31) | CYP1A2FAAH | |
| SCHEMBL9758555 | 0.97 | CYP1A2 (0.34) | CYP1A2LMNAMAPK1HTT | |
| SCHEMBL9757737 | 0.96 | FAAH (0.30) | CYP1A2FAAHHTT | |
| SCHEMBL9757843 | 0.96 | FAAH (0.30) | CYP1A2FAAH | |
| SCHEMBL9757836 | 0.96 | FAAH (0.30) | CYP1A2FAAH | |
| SCHEMBL9757742 | 0.96 | FAAH (0.30) | CYP1A2FAAHHTT | |
| SCHEMBL9759337 | 0.95 | — | — |
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-4985583-A | Liquid Crystals | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1991-01-15 | — | — | US | disclosed |