Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RX7 | Q99572 | 2/20 | 0.43 |
| ▸ | SSTR3 | P32745 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 4/20 | 0.40 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.40 |
| ▸ | RPS6KA1 | Q15418 | 1/20 | 0.39 |
| ▸ | MCHR1 | Q99705 | 7/20 | 0.39 |
| ▸ | PPARG | P37231 | 3/20 | 0.39 |
| ▸ | HTR1A | P08908 | 1/20 | 0.39 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.39 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.39 |
| ▸ | HRH1 | P35367 | 1/20 | 0.39 |
| ▸ | HTR2B | P41595 | 1/20 | 0.39 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.37 |
| ▸ | CDK2 | P24941 | 1/20 | 0.37 |
| ▸ | MAPK3 | P27361 | 1/20 | 0.37 |
| ▸ | AR | P10275 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL9924253 | 0.94 | MAPK1 (0.43) | P2RX7SSTR3MAPK1EPHX2MCHR1 | |
| SCHEMBL9924234 | 0.92 | EPHX2 (0.41) | P2RX7SSTR3EPHX2MCHR1HTR1A | |
| SCHEMBL9924235 | 0.87 | EPHX2 (0.46) | MAPK1EPHX2MCHR1HTR1AADRA2A | |
| SCHEMBL9924269 | 0.87 | SSTR3 (0.45) | P2RX7SSTR3MAPK1RPS6KA1MCHR1 | |
| SCHEMBL9924245 | 0.86 | EPHX2 (0.49) | P2RX7EPHX2MCHR1 | |
| SCHEMBL9924151 | 0.85 | EPHX2 (0.48) | P2RX7EPHX2MCHR1HTR1AADRA2A | |
| SCHEMBL9924236 | 0.85 | SMYD3 (0.42) | P2RX7MAPK1MCHR1ADRA2A | |
| SCHEMBL9924252 | 0.85 | PDE4B (0.42) | EPHX2MCHR1HTR1AADRA2AADRA1A | |
| SCHEMBL17206705 | 0.84 | MAPK14 (0.42) | MAPK1EPHX2MCHR1HTR1AADRA2A | |
| SCHEMBL9924067 | 0.82 | SMN1; SMN2 (0.43) | P2RX7SSTR3MCHR1PPARGALDH1A1 |
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 |