Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | REN | P00797 | 7/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 6/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.34 |
| ▸ | CDK9 | P50750 | 1/20 | 0.34 |
| ▸ | TLR9 | Q9NR96 | 2/20 | 0.33 |
| ▸ | TLR8 | Q9NR97 | 2/20 | 0.33 |
| ▸ | TLR7 | Q9NYK1 | 2/20 | 0.33 |
| ▸ | FPR1 | P21462 | 1/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.32 |
| ▸ | HTR2A | P28223 | 2/20 | 0.32 |
| ▸ | HTR1A | P08908 | 1/20 | 0.32 |
| ▸ | HTR1D | P28221 | 1/20 | 0.32 |
| ▸ | HTR1B | P28222 | 1/20 | 0.32 |
| ▸ | HTR1E | P28566 | 1/20 | 0.32 |
| ▸ | HTR7 | P34969 | 1/20 | 0.32 |
| ▸ | HTR2B | P41595 | 1/20 | 0.32 |
| ▸ | HTR3A | P46098 | 1/20 | 0.32 |
| ▸ | HTR5A | P47898 | 1/20 | 0.32 |
| ▸ | HTR6 | P50406 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL534505 | 1.00 | REN (0.36) | RENKCNH2CYP3A4CCNT1CDK9 | |
| SCHEMBL534503 | 1.00 | REN (0.36) | RENKCNH2CYP3A4CCNT1CDK9 | |
| SCHEMBL533991 | 0.76 | REN (0.54) | RENKCNH2CYP3A4 | |
| SCHEMBL556935 | 0.76 | PROKR1 (0.42) | KCNH2SLC6A4 | |
| SCHEMBL25308161 | 0.70 | PDE4B (0.51) | CCNT1CDK9TLR9TLR8TLR7 | |
| SCHEMBL22952999 | 0.70 | ADRA2A (0.45) | CCNT1CDK9TLR9TLR8TLR7 | |
| SCHEMBL556568 | 0.70 | SLC6A4 (0.32) | RENKCNH2CYP3A4SLC6A4HTR2B | |
| SCHEMBL556569 | 0.70 | SLC6A4 (0.32) | RENKCNH2CYP3A4SLC6A4HTR2B | |
| SCHEMBL556570 | 0.70 | SLC6A4 (0.32) | RENKCNH2CYP3A4SLC6A4HTR2B | |
| SCHEMBL22953003 | 0.68 | ADRA2A (0.45) | TLR9TLR8TLR7HTR2AHTR2C |
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-2413941-A1 | RENIN INHIBITORS | Merck Sharp & Dohme Corp. (US) | 2012-02-08 | — | — | EP | disclosed |
| WO-2010114978-A1 | RENIN INHIBITORS | MERCK SHARP & DOHME CORP. (US) | 2010-10-07 | — | — | WO | disclosed |