Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TNKS | O95271 | 1/20 | 0.49 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.49 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.46 |
| ▸ | ULK1 | O75385 | 1/20 | 0.46 |
| ▸ | CDK9 | P50750 | 5/20 | 0.44 |
| ▸ | PBK | Q96KB5 | 1/20 | 0.43 |
| ▸ | SLC6A1 | P30531 | 2/20 | 0.42 |
| ▸ | SLC6A11 | P48066 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | SLC6A13 | Q9NSD5 | 1/20 | 0.42 |
| ▸ | WNT1 | P04628 | 4/20 | 0.42 |
| ▸ | GSK3B | P49841 | 4/20 | 0.42 |
| ▸ | DYRK1A | Q13627 | 4/20 | 0.42 |
| ▸ | CHKA | P35790 | 1/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL6735320 | 0.92 | ROCK2 (0.44) | TNKSTNKS2ROCK2ULK1CDK9 | |
| SCHEMBL21639971 | 0.85 | CHKA (0.44) | SMN1; SMN2WNT1GSK3BDYRK1ACHKA | |
| Hydrochloric Acid SCHEMBL21750354 | 0.84 | CHKA (0.43) | SMN1; SMN2WNT1GSK3BDYRK1ACHKA | |
| SCHEMBL3645472 | 0.82 | CHKA (0.54) | ROCK2PBKSMN1; SMN2GSK3BCHKA | |
| SCHEMBL19816875 | 0.77 | ULK1 (0.47) | TNKSTNKS2ROCK2ULK1CDK9 | |
| SCHEMBL19816559 | 0.77 | ULK1 (0.47) | TNKSTNKS2ROCK2ULK1CDK9 | |
| SCHEMBL19816556 | 0.77 | ULK1 (0.47) | TNKSTNKS2ROCK2ULK1CDK9 | |
| SCHEMBL31078433 | 0.75 | NPC1 (0.54) | PBKTSHRSMN1; SMN2ALOX15KDM4E | |
| SCHEMBL1552756 | 0.74 | ULK1 (0.56) | TNKSTNKS2ROCK2ULK1CDK9 | |
| Hydrochloric Acid SCHEMBL1761032 | 0.74 | NPC1 (0.53) | PBKTSHRSMN1; SMN2ALOX15KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| EP-2229363-A1 | RENIN INHIBITORS | Merck Frosst Canada Ltd. (CA) | 2010-09-22 | — | — | EP | disclosed |
| WO-2009070869-A1 | RENIN INHIBITORS | MERCK FROSST CANADA LTD. (CA) | 2009-06-11 | — | — | WO | disclosed |