Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRM1 | P35372 | 1/20 | 0.58 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | THRB | P10828 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | USP2 | O75604 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | SPHK1 | Q9NYA1 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | CES2 | O00748 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | DNM1 | Q05193 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL16299179 | 0.98 | OPRM1 (0.56) | OPRM1TP53HTTMEN1THRB | |
| SCHEMBL6909501 | 0.98 | OPRM1 (0.56) | OPRM1TP53HTTMEN1THRB | |
| SCHEMBL10687484 | 0.93 | OPRM1 (0.54) | OPRM1TP53HTTMEN1THRB | |
| Isopropylamine SCHEMBL9717358 | 0.83 | HTT (0.56) | OPRM1HTTMEN1THRBKMT2A | |
| SCHEMBL10554106 | 0.83 | — | — | |
| SCHEMBL6734023 | 0.83 | OPRM1 (0.41) | OPRM1TP53TSHR | |
| SCHEMBL7790055 | 0.82 | HTT (0.50) | OPRM1HTTMEN1THRBKMT2A | |
| SCHEMBL11477603 | 0.82 | OPRM1 (0.58) | OPRM1TP53HTTMEN1THRB | |
| SCHEMBL7745531 | 0.82 | HTT (0.50) | OPRM1HTTMEN1THRBKMT2A | |
| SCHEMBL10607828 | 0.82 | HTT (0.57) | OPRM1HTTMEN1THRBKMT2A |
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-2010010412-A2 | METHOD FOR THE PREPARATION OF N-METHYL-ARYLOXY-PROPANAMINE DERIVATIVES | LUKÁCS, Gyula (HU) | 2010-01-28 | — | — | WO | disclosed |