Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NMT1 | P30419 | 1/20 | 0.52 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.51 |
| ▸ | HRH3 | Q9Y5N1 | 6/20 | 0.50 |
| ▸ | SCN1A | P35498 | 1/20 | 0.50 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.50 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.50 |
| ▸ | AGTR2 | P50052 | 1/20 | 0.49 |
| ▸ | OPRM1 | P35372 | 4/20 | 0.49 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.47 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.47 |
| ▸ | DRD2 | P14416 | 1/20 | 0.47 |
| ▸ | HTR2A | P28223 | 1/20 | 0.47 |
| ▸ | HTR2C | P28335 | 1/20 | 0.47 |
| ▸ | HTR2B | P41595 | 1/20 | 0.47 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.46 |
| ▸ | HTR1A | P08908 | 1/20 | 0.46 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.46 |
| ▸ | DRD1 | P21728 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL21535464 | 0.82 | OPRM1 (0.59) | SIGMAR1HRH3AGTR2OPRM1OPRK1 | |
| SCHEMBL27517665 | 0.82 | OPRM1 (0.55) | SIGMAR1HRH3AGTR2OPRM1OPRK1 | |
| SCHEMBL4465883 | 0.81 | AGTR2 (0.53) | HRH3AGTR2OPRM1 | |
| SCHEMBL5140977 | 0.80 | CARM1 (0.66) | SIGMAR1HRH3SCN1ASCN2ASCN3A | |
| SCHEMBL27807030 | 0.80 | OPRM1 (0.57) | SIGMAR1HRH3AGTR2OPRM1OPRK1 | |
| SCHEMBL3118815 | 0.78 | OPRM1 (0.48) | SIGMAR1HRH3AGTR2OPRM1OPRK1 | |
| SCHEMBL4673427 | 0.78 | HRH1 (0.50) | SIGMAR1OPRM1OPRK1OPRD1HTR2A | |
| Hydrochloric Acid SCHEMBL4472282 | 0.76 | HRH1 (0.49) | SIGMAR1OPRM1OPRK1OPRD1HTR2A | |
| SCHEMBL9388165 | 0.76 | SLC18A3 (0.58) | NMT1SIGMAR1HRH3 | |
| SCHEMBL15186465 | 0.76 | OPRM1 (0.52) | SIGMAR1HRH3OPRM1OPRK1OPRD1 |
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-2980076-B1 | Pyrazolyl derivatives | UNIV DUNDEE (GB) | 2017-05-31 | — | — | EP | disclosed |
| EP-1071424-A1 | COMPOSITION COMPRISING L-CARNITINE OR AN ALKANOYL L-CARNITINE AND NADH AND/OR NADPH | Sigma-Tau Healthscience S.p.A. (IT) | 2001-01-31 | — | — | EP | disclosed |
| WO-1999053921-A1 | COMPOSITION COMPRISING L-CARNITINE OR AN ALKANOYL L-CARNITINE AND NADH AND/OR NADPH | SIGMA-TAU HEALTHSCIENCE S.P.A. (IT) | 1999-10-28 | — | — | WO | disclosed |