Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.49 |
| ▸ | MGLL | Q99685 | 4/20 | 0.48 |
| ▸ | FAAH | O00519 | 3/20 | 0.46 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL28092729 | 0.82 | MGLL (0.48) | CYP1A2CYP2D6MGLLFAAHTRPV1 | |
| SCHEMBL2106013 | 0.81 | CYP1A2 (0.53) | CYP1A2CYP2D6MGLLFAAHTRPV1 | |
| SCHEMBL6823988 | 0.79 | GAA (0.61) | MGLLGAA | |
| SCHEMBL10832502 | 0.78 | CA1 (0.49) | — | |
| SCHEMBL783319 | 0.78 | CYP1A2 (0.52) | CYP1A2CYP2D6MGLLFAAHTRPV1 | |
| SCHEMBL1333584 | 0.77 | CYP1A2 (0.61) | CYP1A2CYP2D6MGLLFAAH | |
| SCHEMBL18424173 | 0.75 | CYP1A2 (0.73) | CYP1A2CYP2D6MGLLFAAH | |
| SCHEMBL26042174 | 0.75 | CYP1A2 (0.69) | CYP1A2CYP2D6MGLLFAAH | |
| SCHEMBL13397890 | 0.74 | CYP1A2 (0.61) | CYP1A2CYP2D6MGLLFAAHTRPV1 | |
| SCHEMBL640619 | 0.74 | CYP1A2 (0.76) | CYP1A2CYP2D6MGLLFAAH |
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 |
|---|---|---|---|---|---|---|---|
| US-4107304-A | Oxo-imidazolidine substituted cephalosporins and antibacterial compositions and methods of combatting bacteria employing them | BAYER AKTIENGESELLSCHAFT (DE) | 1978-08-15 | — | — | US | disclosed |
| US-4093722-A | ANTIBIOTICS | BAYER AKTIENGESELLSCHAFT (DT) | 1978-06-06 | — | — | US | disclosed |
| US-4086340-A | ANTIBIOTIC; ANIMAL GROWTH PROMOTER | BAYER AKTIENGESELLSCHAFT (DT) | 1978-04-25 | — | — | US | disclosed |