Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | CHRNA1 | P02708 | 1/20 | 0.44 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.44 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.44 |
| ▸ | CHRNB2 | P17787 | 2/20 | 0.44 |
| ▸ | CHRNA4 | P43681 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.34 |
| ▸ | POLB | P06746 | 3/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | DRD4 | P21917 | 1/20 | 0.32 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.32 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.32 |
| ▸ | MAOB | P27338 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | CXCR3 | P49682 | 1/20 | 0.32 |
| ▸ | FPR2 | P25090 | 1/20 | 0.31 |
| ▸ | PROKR1 | Q8TCW9 | 1/20 | 0.31 |
| ▸ | GRM2 | Q14416 | 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 | |
|---|---|---|---|---|
| SCHEMBL9408592 | 0.87 | CHRNB2 (0.46) | SMN1; SMN2CHRNA1CHRNA3CHRNA7CHRNB2 | |
| SCHEMBL9408704 | 0.86 | CHRNB2 (0.49) | SMN1; SMN2CHRNA1CHRNA3CHRNA7CHRNB2 | |
| SCHEMBL9408594 | 0.85 | SMN1; SMN2 (0.64) | SMN1; SMN2CHRNA1CHRNA3CHRNA7CHRNB2 | |
| SCHEMBL10911533 | 0.83 | MAPT (0.48) | SMN1; SMN2CHRNA1CHRNA3CHRNA7CHRNB2 | |
| SCHEMBL9408574 | 0.82 | CHRNB2 (0.46) | SMN1; SMN2CHRNA1CHRNA3CHRNA7CHRNB2 | |
| SCHEMBL9408579 | 0.82 | CHRNA1 (0.66) | SMN1; SMN2CHRNA1CHRNA3CHRNA7CHRNB2 | |
| SCHEMBL10892508 | 0.81 | CHRNB2 (0.43) | SMN1; SMN2CHRNA1CHRNA3CHRNA7CHRNB2 | |
| SCHEMBL7993660 | 0.81 | CHRNB2 (0.46) | SMN1; SMN2CHRNA1CHRNA3CHRNA7CHRNB2 | |
| Hydrochloric Acid SCHEMBL10734635 | 0.80 | CHRNB2 (0.46) | SMN1; SMN2CHRNA1CHRNA3CHRNA7CHRNB2 | |
| SCHEMBL1019754 | 0.80 | CHRNB2 (0.70) | SMN1; SMN2CHRNA1CHRNA3CHRNA7CHRNB2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0623601-A1 | N-(3-Fluorobenzyl)heterocyclic derivatives and their use as pesticides | SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) | 1994-11-09 | — | — | EP | disclosed |