Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRM1 | P35372 | 5/20 | 0.37 |
| ▸ | OPRK1 | P41145 | 5/20 | 0.37 |
| ▸ | OPRL1 | P41146 | 5/20 | 0.37 |
| ▸ | IDH1 | O75874 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | F11 | P03951 | 3/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | NOS1 | P29475 | 1/20 | 0.31 |
| ▸ | CCKBR | P32239 | 2/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.30 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.30 |
| ▸ | SLC22A2 | O15244 | 1/20 | 0.30 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.30 |
| ▸ | SLC22A3 | O75751 | 1/20 | 0.30 |
| ▸ | HTR3B | O95264 | 1/20 | 0.30 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.30 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.30 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL10185550 | 0.84 | IDH1 (0.44) | OPRM1OPRK1OPRL1IDH1KDM4E | |
| SCHEMBL10183302 | 0.83 | PTAFR (0.41) | OPRM1OPRK1OPRL1IDH1 | |
| SCHEMBL10185959 | 0.83 | IDH1 (0.52) | OPRM1OPRK1OPRL1IDH1CCKBR | |
| SCHEMBL10185987 | 0.83 | IDH1 (0.42) | OPRM1OPRK1OPRL1IDH1KDM4E | |
| SCHEMBL10183799 | 0.83 | IDH1 (0.42) | OPRM1OPRK1OPRL1IDH1KDM4E | |
| SCHEMBL10183929 | 0.82 | CHRM2 (0.43) | OPRM1OPRK1OPRL1KDM4EKMT2A | |
| SCHEMBL10183670 | 0.80 | TRPM8 (0.41) | OPRM1OPRK1OPRL1TRPM8 | |
| SCHEMBL10185834 | 0.80 | IDH1 (0.39) | OPRM1OPRK1OPRL1IDH1KDM4E | |
| SCHEMBL10185988 | 0.79 | IDH1 (0.39) | OPRM1OPRK1OPRL1IDH1CCKBR | |
| SCHEMBL10183771 | 0.79 | IDH1 (0.39) | OPRM1OPRK1OPRL1IDH1CCKBR |
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-2012009678-A1 | THERAPEUTICALLY ACTIVE COMPOSITIONS AND THEIR METHOD OF USE | AGIOS PHARMACEUTICALS, INC. (US) | 2012-01-19 | — | — | WO | disclosed |