Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 5/20 | 0.42 |
| ▸ | DRD3 | P35462 | 5/20 | 0.42 |
| ▸ | DRD1 | P21728 | 1/20 | 0.42 |
| ▸ | DRD4 | P21917 | 1/20 | 0.42 |
| ▸ | DRD5 | P21918 | 1/20 | 0.42 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.42 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | OPRM1 | P35372 | 4/20 | 0.40 |
| ▸ | OPRD1 | P41143 | 4/20 | 0.40 |
| ▸ | OPRK1 | P41145 | 4/20 | 0.40 |
| ▸ | S1PR1 | P21453 | 3/20 | 0.39 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | CNR1 | P21554 | 1/20 | 0.38 |
| ▸ | CNR2 | P34972 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 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 | |
|---|---|---|---|---|
| SCHEMBL13337771 | 0.86 | MAPT (0.40) | DRD3DRD1NR1H2NR1H3ALDH1A1 | |
| SCHEMBL11330980 | 0.86 | SIGMAR1 (0.45) | ALDH1A1CYP3A4 | |
| SCHEMBL9446203 | 0.85 | NOS1 (0.42) | DRD2DRD3DRD1DRD4DRD5 | |
| SCHEMBL711658 | 0.82 | PTGS2 (0.35) | NR1H2NR1H3CYP3A4S1PR1MAPT | |
| SCHEMBL11786942 | 0.80 | NR1H2 (0.49) | DRD2DRD3NR1H2NR1H3OPRM1 | |
| SCHEMBL9446165 | 0.79 | ALDH1A1 (0.49) | ALDH1A1CYP3A4S1PR1TSHRMAPT | |
| SCHEMBL10605812 | 0.79 | KMT2A (0.47) | ALDH1A1CYP3A4TSHRMAPTMEN1 | |
| SCHEMBL11336034 | 0.79 | KMT2A (0.58) | DRD2DRD3DRD1DRD4DRD5 | |
| SCHEMBL15127573 | 0.79 | S1PR1 (0.57) | DRD2DRD3DRD1DRD4DRD5 | |
| SCHEMBL7212314 | 0.79 | ALDH1A1 (0.56) | NR1H2NR1H3ALDH1A1CYP3A4S1PR1 |
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 |
|---|---|---|---|---|---|---|---|
| US-3941580-A | N,N-BIS(2-METHOXY-3,6-DICHLORO-BENZOYL-OXYALKYL) ANILINES | VELSICOL CHEMICAL CORPORATION (US) | 1976-03-02 | — | — | US | disclosed |