Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM5 | P41594 | 1/20 | 0.47 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 7/20 | 0.44 |
| ▸ | CCR3 | P51677 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 5/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | KCNK9 | Q9NPC2 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | DRD4 | P21917 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | CXCR6 | O00574 | 1/20 | 0.40 |
| ▸ | KLK7 | P49862 | 1/20 | 0.40 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.40 |
| ▸ | CDK2 | P24941 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL9924258 | 0.92 | GRM5 (0.47) | GRM5KMT2ACCR3MEN1KCNK9 | |
| SCHEMBL9924333 | 0.92 | NPC1 (0.44) | GRM5KMT2ACCR3MEN1L3MBTL1 | |
| SCHEMBL9924083 | 0.91 | NPC1 (0.44) | GRM5KMT2ACCR3MEN1L3MBTL1 | |
| SCHEMBL9924071 | 0.90 | KMT2A (0.43) | GRM5KMT2AMEN1CYP2C19NPC1 | |
| SCHEMBL9924332 | 0.89 | SLC6A9 (0.41) | GRM5MAPK14KMT2ACCR3MEN1 | |
| SCHEMBL9924457 | 0.87 | NPC1 (0.43) | GRM5KMT2ACCR3MEN1NPC1 | |
| SCHEMBL9924070 | 0.87 | GRM4 (0.40) | KMT2AMEN1ALDH1A1 | |
| SCHEMBL9924329 | 0.85 | SLC6A9 (0.40) | GRM5MAPK14KMT2ACCR3L3MBTL1 | |
| SCHEMBL9924257 | 0.83 | GRM5 (0.42) | GRM5KMT2ACCR3MEN1NPC1 | |
| SCHEMBL9924090 | 0.82 | APOB (0.40) | MAPK14KMT2AMEN1SMN1; SMN2ALDH1A1 |
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 |