Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB2 | P17787 | 4/20 | 0.52 |
| ▸ | CHRNA4 | P43681 | 4/20 | 0.52 |
| ▸ | CHRNA7 | P36544 | 2/20 | 0.50 |
| ▸ | MEN1 | O00255 | 3/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | CHRM2 | P08172 | 3/20 | 0.42 |
| ▸ | CHRM4 | P08173 | 2/20 | 0.42 |
| ▸ | CHRM5 | P08912 | 2/20 | 0.42 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.42 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.42 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL28094487 | 0.98 | CHRNB2 (0.51) | CHRNB2CHRNA4CHRNA7MEN1KMT2A | |
| SCHEMBL1721243 | 0.95 | CHRNB2 (0.51) | CHRNB2CHRNA4CHRNA7MEN1KMT2A | |
| SCHEMBL23373178 | 0.80 | CHRNB2 (0.50) | CHRNB2CHRNA4CHRNA7MEN1KMT2A | |
| SCHEMBL20795353 | 0.80 | CHRNB4 (0.56) | CHRNB2CHRNA4CHRNA7MEN1KMT2A | |
| SCHEMBL28366930 | 0.80 | CHRNB4 (0.56) | CHRNB2CHRNA4CHRNA7MEN1KMT2A | |
| SCHEMBL20795352 | 0.80 | CHRNB4 (0.56) | CHRNB2CHRNA4CHRNA7MEN1KMT2A | |
| SCHEMBL11277050 | 0.80 | CHRNB2 (0.46) | CHRNB2CHRNA4CHRNA7MEN1KMT2A | |
| Hydrochloric Acid SCHEMBL28072134 | 0.79 | CHRNB2 (0.49) | CHRNB2CHRNA4CHRNA7MEN1KMT2A | |
| Hydrochloric Acid SCHEMBL28072135 | 0.79 | CHRNB2 (0.49) | CHRNB2CHRNA4CHRNA7MEN1KMT2A | |
| SCHEMBL2322176 | 0.78 | CHRNB2 (0.42) | CHRNB2CHRNA4CHRNA7MEN1KMT2A |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4155909-A | INSECTICIDES | PHILIP MORRIS INCORPORATED (US) | 1979-05-22 | — | — | US | claimed |
| EP-0000106-B1 | 2-ALKYL NICOTINOIDS AND PROCESSES FOR THEIR PRODUCTION AND USE | PHILIP MORRIS INCORPORATED (US) | 1982-02-17 | — | — | EP | disclosed |
| US-4220781-A | QUARTINIZATION, REARRANGEMENT AND REDUCTION | PHILIP MORRIS, INC. (US) | 1980-09-02 | — | — | US | disclosed |
| US-4155909-A | INSECTICIDES | PHILIP MORRIS INCORPORATED (US) | 1979-05-22 | — | — | US | disclosed |
| EP-0000106-A1 | 2-Alkyl nicotinoids and processes for their production and use | PHILIP MORRIS INCORPORATED (US) | 1978-12-20 | — | — | EP | disclosed |