Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MGLL | Q99685 | 3/20 | 0.37 |
| ▸ | TACR1 | P25103 | 1/20 | 0.37 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.35 |
| ▸ | OPRD1 | P41143 | 2/20 | 0.35 |
| ▸ | NAMPT | P43490 | 1/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.33 |
| ▸ | GABRD | O14764 | 1/20 | 0.33 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.33 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.33 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.33 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.33 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.33 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.33 |
| ▸ | GABRA4 | P48169 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.32 |
| ▸ | HTR2C | P28335 | 2/20 | 0.32 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.32 |
| ▸ | HTR7 | P34969 | 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 | |
|---|---|---|---|---|
| SCHEMBL16182215 | 0.84 | TACR1 (0.41) | MGLLTACR1OPRD1NAMPTKCNH2 | |
| SCHEMBL18422847 | 0.84 | TACR1 (0.51) | MGLLTACR1OPRM1OPRD1NAMPT | |
| SCHEMBL20397229 | 0.82 | MGLL (0.54) | MGLLTACR1OPRD1NAMPTKCNH2 | |
| Hydrochloric Acid SCHEMBL2422141 | 0.77 | SLC6A2 (0.44) | KCNH2SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL18423505 | 0.74 | SLC6A3 (0.43) | MGLLTACR1OPRD1GABRA1HTR2C | |
| SCHEMBL20408762 | 0.73 | POLB (0.41) | TACR1MAPTALOX15ALOX12SLC6A2 | |
| Hydrochloric Acid SCHEMBL2434241 | 0.73 | SLC6A2 (0.42) | MGLLTACR1OPRD1GABRA1HTR2C | |
| Hydrochloric Acid SCHEMBL2425833 | 0.73 | SLC6A2 (0.42) | MGLLTACR1OPRD1GABRA1HTR2C | |
| SCHEMBL20412570 | 0.73 | CDK7 (0.33) | OPRM1OPRD1NAMPTKCNH2 | |
| Hydrochloric Acid SCHEMBL2424034 | 0.71 | MAOB (0.42) | OPRM1OPRD1KCNH2SLC6A2SLC6A4 |
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-2018026371-A1 | DUAL NAV1.2/5HT2A INHIBITORS FOR TREATING CNS DISORDERS | SUNOVION PHARMACEUTICALS INC. (US) | 2018-02-08 | — | — | WO | disclosed |