Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCHE | P06276 | 6/20 | 0.52 |
| ▸ | ACHE | P22303 | 6/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | CA12 | O43570 | 3/20 | 0.43 |
| ▸ | CA1 | P00915 | 3/20 | 0.43 |
| ▸ | CA2 | P00918 | 3/20 | 0.43 |
| ▸ | CA9 | Q16790 | 3/20 | 0.43 |
| ▸ | CHRM2 | P08172 | 4/20 | 0.42 |
| ▸ | CHRM1 | P11229 | 3/20 | 0.42 |
| ▸ | CHRM4 | P08173 | 2/20 | 0.42 |
| ▸ | CHRM5 | P08912 | 2/20 | 0.42 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.42 |
| ▸ | DRD2 | P14416 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL9116748 | 0.97 | BCHE (0.50) | BCHEACHEALDH1A1CA12CA1 | |
| SCHEMBL8369522 | 0.90 | SIGMAR1 (0.45) | BCHEACHECA12CA1CA2 | |
| SCHEMBL8369524 | 0.86 | BCHE (0.43) | BCHEACHEALDH1A1CHRM2CHRM1 | |
| SCHEMBL9116823 | 0.83 | CYP3A4 (0.54) | BCHEACHEALDH1A1CA12CA1 | |
| SCHEMBL9116804 | 0.81 | CHRM2 (0.41) | ALDH1A1CHRM2CHRM1CHRM4CHRM5 | |
| SCHEMBL8364111 | 0.80 | ACHE (0.60) | BCHEACHECHRM2CHRM1 | |
| SCHEMBL9119545 | 0.80 | BCHE (0.63) | BCHEACHECHRM2CHRM1 | |
| SCHEMBL8364110 | 0.80 | ACHE (0.60) | BCHEACHECHRM2CHRM1 | |
| Hydrochloric Acid SCHEMBL9117768 | 0.79 | ACHE (0.59) | BCHEACHECHRM2CHRM1 | |
| Hydrochloric Acid SCHEMBL9116685 | 0.79 | ACHE (0.59) | BCHEACHECHRM2CHRM1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0738144-A4 | PHENYLMETHYL HEXANAMIDES, AND THE USE THEREOF | SMITHKLINE BEECHAM CORP (US) | 1999-06-30 | — | — | EP | disclosed |
| EP-0738144-A1 | PHENYLMETHYL HEXANAMIDES, AND THE USE THEREOF | SMITHKLINE BEECHAM CORPORATION (US) | 1996-10-23 | — | — | EP | disclosed |
| WO-1995017888-A1 | PHENYLMETHYL HEXANAMIDES, AND THE USE THEREOF | SMITHKLINE BEECHAM CORPORATION (US) | 1995-07-06 | — | — | WO | disclosed |