Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MCHR1 | Q99705 | 3/20 | 0.37 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.37 |
| ▸ | HRH1 | P35367 | 2/20 | 0.37 |
| ▸ | HTR2B | P41595 | 2/20 | 0.37 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.37 |
| ▸ | PDE4B | Q07343 | 2/20 | 0.37 |
| ▸ | PDE4A | P27815 | 1/20 | 0.37 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.37 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.37 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.36 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.36 |
| ▸ | SLC6A9 | P48067 | 4/20 | 0.36 |
| ▸ | SLC6A5 | Q9Y345 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.36 |
| ▸ | MC5R | P33032 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | KCNQ3 | O43525 | 1/20 | 0.34 |
| ▸ | KCNQ2 | O43526 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL17206691 | 0.93 | KCNQ3 (0.41) | MCHR1ADRA2AHRH1HTR2BADRA1A | |
| SCHEMBL9924419 | 0.93 | KCNQ3 (0.41) | MCHR1ADRA2AHRH1HTR2BADRA1A | |
| SCHEMBL9901952 | 0.93 | KCNQ3 (0.41) | MCHR1ADRA2AHRH1HTR2BADRA1A | |
| SCHEMBL9900852 | 0.93 | KCNQ3 (0.41) | MCHR1ADRA2AHRH1HTR2BADRA1A | |
| SCHEMBL9900854 | 0.93 | KCNQ3 (0.41) | MCHR1ADRA2AHRH1HTR2BADRA1A | |
| SCHEMBL17206704 | 0.92 | CYP2D6 (0.37) | PDE4BPDE4APDE4CPDE4DEPHX2 | |
| SCHEMBL9924215 | 0.85 | SLC6A9 (0.41) | EPHX2GRM4SLC6A9SLC6A5TP53 | |
| SCHEMBL9924439 | 0.84 | GRM5 (0.39) | GRM4SLC6A9TP53KCNQ3KCNQ2 | |
| SCHEMBL9924083 | 0.84 | NPC1 (0.44) | MCHR1HTR2BGRM4TP53MDM2 | |
| SCHEMBL17206719 | 0.83 | DCUN1D1 (0.47) | EPHX2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9169199-B2 | Cycloalkyl guanidine F1F0-ATPase inhibitors and therapeutic uses thereof | LYCERA CORPORATION (US) | 2015-10-27 | — | — | US | disclosed |
| WO-2012078867-A2 | CYCLOALKYL GUANIDINE F1F0-ATPASE INHIBITORS AND THERAPEUTIC USES THEREOF | LYCERA CORPORATION (US) | 2012-06-14 | — | — | WO | disclosed |