Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RX4 | Q99571 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | ELANE | P08246 | 1/20 | 0.34 |
| ▸ | CACNA1F | O60840 | 1/20 | 0.34 |
| ▸ | CACNA1D | Q01668 | 1/20 | 0.34 |
| ▸ | CACNA1S | Q13698 | 1/20 | 0.34 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.33 |
| ▸ | MAPT | P10636 | 3/20 | 0.33 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.33 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.33 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.31 |
| ▸ | HPGD | P15428 | 2/20 | 0.31 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 2/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL30250427 | 0.81 | BRD4 (0.40) | ALDH1A1TSHRKDM4EGAASMN1; SMN2 | |
| SCHEMBL6991005 | 0.81 | BRD4 (0.40) | ALDH1A1TSHRKDM4EGAASMN1; SMN2 | |
| SCHEMBL31305217 | 0.73 | MAPT (0.35) | ALDH1A1TSHRKDM4EGAASMN1; SMN2 | |
| SCHEMBL10980767 | 0.64 | ALDH1A1 (0.38) | P2RX4ALDH1A1KDM4EGAASMN1; SMN2 | |
| SCHEMBL29975999 | 0.64 | GAA (0.39) | P2RX4ALDH1A1KDM4EGAAMAPT | |
| SCHEMBL28544078 | 0.64 | GAA (0.39) | P2RX4ALDH1A1KDM4EGAAMAPT | |
| SCHEMBL4611922 | 0.63 | P2RX4 (0.40) | P2RX4ALDH1A1TSHRELANECACNA1F | |
| SCHEMBL6097775 | 0.63 | ALDH1A1 (0.41) | P2RX4ALDH1A1TSHRKDM4EGAA | |
| SCHEMBL31448339 | 0.61 | MAPT (0.43) | P2RX4ALDH1A1KDM4EGAASMN1; SMN2 | |
| SCHEMBL28059865 | 0.61 | MAPT (0.43) | P2RX4ALDH1A1KDM4EGAASMN1; SMN2 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0830353-B1 | PROCESS FOR THE PREPARATION OF AN HIV PROTEASE INHIBITING COMPOUND | ABBOTT LAB (US) | 2002-04-24 | — | — | EP | disclosed |
| EP-0830353-A1 | PROCESS FOR THE PREPARATION OF AN HIV PROTEASE INHIBITING COMPOUND | Abbott Laboratories (US) | 1998-03-25 | — | — | EP | disclosed |
| WO-1996039398-A1 | PROCESS FOR THE PREPARATION OF AN HIV PROTEASE INHIBITING COMPOUND | ABBOTT LABORATORIES (US) | 1996-12-12 | — | — | WO | disclosed |
| US-5567823-A | Process for the preparation of an HIV protease inhibiting compound | ABBOTT LABORATORIES (US) | 1996-10-22 | — | — | US | disclosed |