Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB2 | P17787 | 2/20 | 0.47 |
| ▸ | CHRNA4 | P43681 | 2/20 | 0.47 |
| ▸ | CA12 | O43570 | 3/20 | 0.43 |
| ▸ | CA1 | P00915 | 3/20 | 0.43 |
| ▸ | CA2 | P00918 | 3/20 | 0.43 |
| ▸ | CA7 | P43166 | 3/20 | 0.43 |
| ▸ | CA9 | Q16790 | 3/20 | 0.43 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.43 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.43 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.43 |
| ▸ | LCK | P06239 | 4/20 | 0.40 |
| ▸ | PTPN1 | P18031 | 3/20 | 0.37 |
| ▸ | PTPN2 | P17706 | 1/20 | 0.37 |
| ▸ | PTPN6 | P29350 | 1/20 | 0.37 |
| ▸ | XDH | P47989 | 1/20 | 0.36 |
| ▸ | EGFR | P00533 | 3/20 | 0.36 |
| ▸ | RGS12 | O14924 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | CAMKK2 | Q96RR4 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| Gentisic Acid SCHEMBL5199171 | 1.00 | CHRNB2 (0.47) | CHRNB2CHRNA4CA12CA1CA2 | |
| Gentisic Acid SCHEMBL620032 | 0.86 | CHRNB2 (0.54) | CHRNB2CHRNA4CA12CA1CA2 | |
| Gentisic Acid SCHEMBL620585 | 0.86 | CHRNB2 (0.54) | CHRNB2CHRNA4CA12CA1CA2 | |
| Gentisic Acid SCHEMBL620587 | 0.86 | CHRNB2 (0.54) | CHRNB2CHRNA4CA12CA1CA2 | |
| SCHEMBL620186 | 0.78 | CHRNB2 (0.67) | CHRNB2CHRNA4CHRNA7 | |
| SCHEMBL620187 | 0.78 | CHRNB2 (0.67) | CHRNB2CHRNA4CHRNA7 | |
| SCHEMBL621573 | 0.78 | CHRNB2 (0.67) | CHRNB2CHRNA4CHRNA7 | |
| SCHEMBL2436962 | 0.78 | CHRNB2 (0.67) | CHRNB2CHRNA4CHRNA7 | |
| SCHEMBL621574 | 0.78 | CHRNB2 (0.67) | CHRNB2CHRNA4CHRNA7 | |
| SCHEMBL2436966 | 0.78 | CHRNB2 (0.67) | CHRNB2CHRNA4CHRNA7 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1814853-A2 | HYDROXYBENZOATE SALTS OF METANICOTINE COMPOUNDS | Targacept, Inc. (US) | 2007-08-08 | — | — | EP | claimed |
| WO-2006053039-A2 | HYDROXYBENZOATE SALTS OF METANICOTINE COMPOUNDS | TARGACEPT, INC. (US) | 2006-05-18 | — | — | WO | claimed |