Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.34 |
| ▸ | CYP19A1 | P11511 | 6/20 | 0.34 |
| ▸ | OPRM1 | P35372 | 9/20 | 0.33 |
| ▸ | OPRD1 | P41143 | 9/20 | 0.33 |
| ▸ | OPRK1 | P41145 | 9/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.33 |
| ▸ | BACE1 | P56817 | 1/20 | 0.32 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL7731754 | 0.99 | OPRM1 (0.34) | SIGMAR1CYP19A1OPRM1OPRD1OPRK1 | |
| SCHEMBL7732444 | 0.89 | OPRM1 (0.34) | OPRM1OPRD1OPRK1EPHX1 | |
| SCHEMBL10652906 | 0.87 | CYP1A2 (0.40) | CYP19A1CYP3A4CYP2C8CYP2D6CYP2C9 | |
| SCHEMBL27776759 | 0.79 | SPHK1 (0.46) | CYP2C9 | |
| SCHEMBL9180980 | 0.76 | SLC6A3 (0.40) | OPRM1 | |
| SCHEMBL21527907 | 0.75 | CYP1A2 (0.39) | OPRM1OPRD1OPRK1CYP3A4CYP2C8 | |
| SCHEMBL8395944 | 0.71 | SLC6A4 (0.45) | SIGMAR1 | |
| SCHEMBL4802565 | 0.71 | CYP1A2 (0.44) | SIGMAR1CYP3A4CYP2C8CYP2D6CYP2C9 | |
| SCHEMBL4802562 | 0.71 | CYP1A2 (0.44) | SIGMAR1CYP3A4CYP2C8CYP2D6CYP2C9 | |
| SCHEMBL8020936 | 0.71 | SLC6A4 (0.48) | CYP3A4CYP2C8CYP2D6CYP2C9CYP2C19 |
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-6476266-B1 | Diamino compound and production process for the same | CHISSO CORPORATION (JP) | 2002-11-05 | — | — | US | disclosed |