Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.43 |
| ▸ | TSHR | P16473 | 2/20 | 0.43 |
| ▸ | SSTR3 | P32745 | 1/20 | 0.41 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 3/20 | 0.38 |
| ▸ | PPARG | P37231 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.35 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.35 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.35 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | WDR5 | P61964 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.35 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.35 |
| ▸ | PDE4D | Q08499 | 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 | |
|---|---|---|---|---|
| SCHEMBL9923856 | 0.95 | CHRM1 (0.42) | SMN1; SMN2TSHRSSTR3CHRM1LMNA | |
| SCHEMBL9924063 | 0.94 | SMN1; SMN2 (0.43) | SMN1; SMN2TSHRSSTR3CHRM1LMNA | |
| SCHEMBL9924273 | 0.92 | CHRM1 (0.41) | SMN1; SMN2TSHRSSTR3CHRM1LMNA | |
| SCHEMBL9924267 | 0.90 | SMN1; SMN2 (0.47) | SMN1; SMN2TSHRSSTR3CHRM1LMNA | |
| SCHEMBL9924066 | 0.88 | CHRM1 (0.41) | SMN1; SMN2TSHRCHRM1LMNAALDH1A1 | |
| SCHEMBL9924269 | 0.87 | SSTR3 (0.45) | SSTR3PPARGALDH1A1MCHR1CYP2C9 | |
| SCHEMBL9923857 | 0.87 | LMNA (0.40) | SMN1; SMN2CHRM1LMNAHTTS1PR3 | |
| SCHEMBL9924276 | 0.86 | EPHX2 (0.42) | SMN1; SMN2TSHRCHRM1LMNAPPARG | |
| SCHEMBL9924270 | 0.86 | HPGD (0.40) | SMN1; SMN2CHRM1LMNAALDH1A1MCHR1 | |
| SCHEMBL9924065 | 0.85 | P2RX7 (0.42) | P2RX7 |
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 |