Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | CA1 | P00915 | 1/20 | 0.30 |
| ▸ | CA2 | P00918 | 1/20 | 0.30 |
| ▸ | NQO2 | P16083 | 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 | |
|---|---|---|---|---|
| SCHEMBL455936 | 0.80 | CYP2A6 (0.45) | CYP2A6CYP1A2KMT2AMEN1CA1 | |
| SCHEMBL2003901 | 0.78 | HTR2A (0.39) | CYP2A6CYP1A2CA1CA2 | |
| SCHEMBL1973142 | 0.77 | CYP2A6 (0.38) | CYP2A6CYP1A2KMT2AMEN1 | |
| SCHEMBL5748025 | 0.75 | CYP2A6 (0.41) | CYP2A6CYP1A2KMT2AMEN1 | |
| SCHEMBL28010056 | 0.75 | TDP1 (0.37) | CYP2A6CYP1A2 | |
| SCHEMBL27848664 | 0.75 | CALM1 (0.42) | CYP2A6CYP1A2KMT2A | |
| SCHEMBL28004178 | 0.74 | KDM4E (0.39) | L3MBTL1CYP2A6CYP1A2KMT2AMEN1 | |
| SCHEMBL2256514 | 0.74 | TLR8 (0.40) | CYP2A6CYP1A2KMT2AMEN1 | |
| SCHEMBL28039386 | 0.72 | SMN1; SMN2 (0.41) | L3MBTL1CYP2A6CYP1A2KMT2AMEN1 | |
| SCHEMBL2253153 | 0.71 | KCNH2 (0.43) | — |
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-4622397-A | HERBICIDES | CIBA-GEIGY CORPORATION (US) | 1986-11-11 | — | — | US | disclosed |