Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IGF1R | P08069 | 2/20 | 0.57 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.57 |
| ▸ | BCHE | P06276 | 3/20 | 0.56 |
| ▸ | ACHE | P22303 | 3/20 | 0.56 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.53 |
| ▸ | DRD1 | P21728 | 3/20 | 0.53 |
| ▸ | DRD3 | P35462 | 3/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.53 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.53 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.53 |
| ▸ | DRD2 | P14416 | 1/20 | 0.53 |
| ▸ | TSHR | P16473 | 1/20 | 0.53 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.53 |
| ▸ | DRD4 | P21917 | 1/20 | 0.53 |
| ▸ | DRD5 | P21918 | 1/20 | 0.53 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.53 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.53 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.53 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.53 |
| ▸ | IDH1 | O75874 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL13886168 | 0.90 | DRD1 (0.59) | IGF1RALOX15DRD1DRD3CYP3A4 | |
| SCHEMBL3157661 | 0.86 | KDM4E (0.51) | IGF1RALOX15BCHEACHEHDAC1 | |
| SCHEMBL10301530 | 0.84 | HIF1A (0.65) | IGF1RALOX15DRD1DRD3CYP3A4 | |
| SCHEMBL31072689 | 0.84 | DRD1 (0.67) | DRD1DRD3CYP3A4CYP2D6TSHR | |
| SCHEMBL31520989 | 0.83 | OPRK1 (0.61) | IGF1RALOX15BCHEACHEDRD1 | |
| SCHEMBL11755956 | 0.83 | OPRK1 (0.61) | IGF1RALOX15BCHEACHEDRD1 | |
| SCHEMBL14301921 | 0.83 | IGF1R (0.56) | IGF1RALOX15HDAC1DRD1DRD3 | |
| SCHEMBL12018644 | 0.81 | SIGMAR1 (0.59) | BCHEACHEHDAC1CYP3A4CYP2D6 | |
| SCHEMBL9720765 | 0.81 | SIGMAR1 (0.59) | BCHEACHEHDAC1CYP3A4CYP2D6 | |
| SCHEMBL107974 | 0.81 | TRPA1 (0.54) | IGF1RALOX15BCHEACHEDRD1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1210318-A1 | METHOD FOR THE PRODUCTION OF ADRENALINE | Boehringer Ingelheim Pharma KG (DE) | 2002-06-05 | — | — | EP | disclosed |
| WO-2001012583-A1 | METHOD FOR THE PRODUCTION OF ADRENALINE | BOEHRINGER INGELHEIM PHARMA KG (DE) | 2001-02-22 | — | — | WO | disclosed |
| US-4960939-A | Process for the preparation of 3,4-di-methoxy-N-methyl-phenethylamine | FARMOS-YHTYMA OY (FI) | 1990-10-02 | — | — | US | disclosed |
| EP-0129383-B1 | PROCESS FOR THE PREPARATION OF 3,4-DI-ISOBUTYRYLOXY-N-METHYL-PHENETHYLAMINE | Farmos-Yhtyma Oy (FI) | 1988-12-28 | — | — | EP | disclosed |
| EP-0129383-A1 | Process for the preparation of 3,4-di-isobutyryloxy-N-methyl-phenethylamine | Farmos-Yhtyma Oy (FI) | 1984-12-27 | — | — | EP | disclosed |