Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB2 | P17787 | 2/20 | 0.46 |
| ▸ | CHRNA4 | P43681 | 2/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | CHRNA1 | P02708 | 1/20 | 0.43 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.43 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.30 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.30 |
| ▸ | CYP11B2 | P19099 | 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 | |
|---|---|---|---|---|
| SCHEMBL9408704 | 0.88 | CHRNB2 (0.49) | CHRNB2CHRNA4SMN1; SMN2CHRNA1CHRNA3 | |
| SCHEMBL9408592 | 0.87 | CHRNB2 (0.46) | CHRNB2CHRNA4SMN1; SMN2CHRNA1CHRNA3 | |
| SCHEMBL7993660 | 0.86 | CHRNB2 (0.46) | CHRNB2CHRNA4SMN1; SMN2CHRNA1CHRNA3 | |
| Hydrochloric Acid SCHEMBL10734635 | 0.85 | CHRNB2 (0.46) | CHRNB2CHRNA4SMN1; SMN2CHRNA1CHRNA3 | |
| SCHEMBL9068992 | 0.84 | CHRNB2 (0.52) | CHRNB2CHRNA4SMN1; SMN2CHRNA1CHRNA3 | |
| SCHEMBL10892508 | 0.84 | CHRNB2 (0.43) | CHRNB2CHRNA4SMN1; SMN2CHRNA1CHRNA3 | |
| Hydrochloric Acid SCHEMBL10483929 | 0.83 | CHRNB2 (0.51) | CHRNB2CHRNA4SMN1; SMN2CHRNA1CHRNA3 | |
| SCHEMBL9408581 | 0.82 | SMN1; SMN2 (0.47) | CHRNB2CHRNA4SMN1; SMN2CHRNA1CHRNA3 | |
| SCHEMBL1019754 | 0.82 | CHRNB2 (0.70) | CHRNB2CHRNA4SMN1; SMN2CHRNA1CHRNA3 | |
| Hydrochloric Acid SCHEMBL10483913 | 0.81 | CHRNB2 (0.69) | CHRNB2CHRNA4SMN1; SMN2CHRNA1CHRNA3 |
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-4590272-A | INSECTICIDES, MITICIDES, NEMATOCIDES | NIHON TOKUSHU NOYAKU SEIZO K.K. (JP) | 1986-05-20 | — | — | US | claimed |
| EP-0623601-A1 | N-(3-Fluorobenzyl)heterocyclic derivatives and their use as pesticides | SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) | 1994-11-09 | — | — | EP | disclosed |