Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTRB1 | P17538 | 1/20 | 0.44 |
| ▸ | KLK5 | Q9Y337 | 1/20 | 0.41 |
| ▸ | PREP | P48147 | 2/20 | 0.40 |
| ▸ | PRCP | P42785 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.39 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.39 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.39 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | REN | P00797 | 1/20 | 0.38 |
| ▸ | ACE | P12821 | 2/20 | 0.38 |
| ▸ | GFER | P55789 | 1/20 | 0.38 |
| ▸ | CTSD | P07339 | 1/20 | 0.38 |
| ▸ | CTSE | P14091 | 1/20 | 0.38 |
| ▸ | BACE1 | P56817 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL7404180 | 0.92 | KLK5 (0.46) | KLK5ADORA3ADORA2AADORA2BADORA1 | |
| SCHEMBL7401649 | 0.82 | CTRB1 (0.48) | CTRB1PRCPTSHRL3MBTL1KDM4E | |
| SCHEMBL7405664 | 0.81 | BACE1 (0.38) | KLK5RENCTSDCTSEBACE1 | |
| SCHEMBL7454378 | 0.81 | BACE1 (0.38) | KLK5RENCTSDCTSEBACE1 | |
| SCHEMBL7403106 | 0.80 | PSEN1 (0.41) | KLK5BACE1PSEN1PSEN2APH1B | |
| SCHEMBL7399393 | 0.80 | PSEN1 (0.41) | KLK5BACE1PSEN1PSEN2APH1B | |
| SCHEMBL7402855 | 0.79 | PSEN1 (0.41) | RENCTSDBACE1PSEN1PSEN2 | |
| SCHEMBL7400659 | 0.78 | PSEN1 (0.42) | BACE1PSEN1PSEN2APH1BNCSTN | |
| SCHEMBL6431948 | 0.78 | CTSB (0.55) | KLK5PSEN1PSEN2APH1BNCSTN | |
| SCHEMBL6431945 | 0.78 | CTSB (0.55) | KLK5PSEN1PSEN2APH1BNCSTN |
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-5750648-A | HUMAN IMMUNODEFICIENCY VIRUS | G.D. SEARLE & CO. (US) | 1998-05-12 | — | — | US | claimed |
| WO-1995006061-A1 | RETROVIRAL PROTEASE INHIBITORS AND COMBINATIONS THEREOF | G.D. SEARLE & CO. (US) | 1995-03-02 | — | — | WO | claimed |