Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KLK5 | Q9Y337 | 1/20 | 0.49 |
| ▸ | ACE | P12821 | 9/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.48 |
| ▸ | PREP | P48147 | 3/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | FKBP1A | P62942 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | ACE2 | Q9BYF1 | 4/20 | 0.43 |
| ▸ | FAP | Q12884 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL7310434 | 0.91 | ACE (0.59) | ACELMNASMN1; SMN2ACE2 | |
| SCHEMBL5967094 | 0.83 | ACE (0.52) | KLK5ACELMNAPREPALDH1A1 | |
| SCHEMBL7304859 | 0.81 | ACE (0.50) | KLK5ACEPREPALDH1A1CYP3A4 | |
| SCHEMBL7305929 | 0.81 | PREP (0.70) | KLK5ACELMNAPREPALDH1A1 | |
| SCHEMBL22209424 | 0.81 | PREP (0.70) | KLK5ACELMNAPREPALDH1A1 | |
| SCHEMBL30051892 | 0.81 | PREP (0.70) | KLK5ACELMNAPREPALDH1A1 | |
| SCHEMBL8198229 | 0.81 | PREP (0.70) | KLK5ACELMNAPREPALDH1A1 | |
| SCHEMBL9814463 | 0.80 | ACE (0.53) | KLK5ACELMNAFKBP1ASMN1; SMN2 | |
| SCHEMBL12525696 | 0.78 | PREP (0.66) | KLK5ACELMNAPREPALDH1A1 | |
| SCHEMBL18620614 | 0.78 | PREP (0.66) | KLK5ACELMNAPREPALDH1A1 |
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-5583146-A | Heterocyclic thrombin inhibitors | BRISTOL-MYERS SQUIBB COMPANY (US) | 1996-12-10 | — | — | US | disclosed |
| EP-0601459-A2 | Sulfonamido heterocyclic thrombin inhibitors | BRISTOL-MYERS SQUIBB COMPANY (US) | 1994-06-15 | — | — | EP | disclosed |