Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCHE | P06276 | 5/20 | 0.50 |
| ▸ | ACHE | P22303 | 5/20 | 0.50 |
| ▸ | CA12 | O43570 | 3/20 | 0.41 |
| ▸ | CA1 | P00915 | 3/20 | 0.41 |
| ▸ | CA2 | P00918 | 3/20 | 0.41 |
| ▸ | CA9 | Q16790 | 3/20 | 0.41 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.41 |
| ▸ | HTR1A | P08908 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.41 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.41 |
| ▸ | DRD2 | P14416 | 3/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | PPARD | Q03181 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL8364121 | 0.97 | BCHE (0.52) | BCHEACHECA12CA1CA2 | |
| SCHEMBL8369522 | 0.87 | SIGMAR1 (0.45) | BCHEACHECA12CA1CA2 | |
| SCHEMBL8369524 | 0.84 | BCHE (0.43) | BCHEACHEADRB2HTR1ANPSR1 | |
| SCHEMBL9116823 | 0.80 | CYP3A4 (0.54) | BCHEACHECA12CA1CA2 | |
| SCHEMBL9117543 | 0.80 | ACHE (0.58) | BCHEACHECHRM2CHRM1PPARD | |
| Hydrochloric Acid SCHEMBL9117790 | 0.79 | ACHE (0.57) | BCHEACHECHRM2CHRM1PPARD | |
| SCHEMBL8364111 | 0.79 | ACHE (0.60) | BCHEACHECHRM2CHRM1PPARD | |
| SCHEMBL8364110 | 0.79 | ACHE (0.60) | BCHEACHECHRM2CHRM1PPARD | |
| SCHEMBL9119545 | 0.79 | BCHE (0.63) | BCHEACHECHRM2CHRM1PPARD | |
| Hydrochloric Acid SCHEMBL9117768 | 0.78 | ACHE (0.59) | BCHEACHECHRM2CHRM1PPARD |
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 |
|---|---|---|---|---|---|---|---|
| WO-1995017888-A1 | PHENYLMETHYL HEXANAMIDES, AND THE USE THEREOF | SMITHKLINE BEECHAM CORPORATION (US) | 1995-07-06 | — | — | WO | disclosed |