Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR1 | P32246 | 2/20 | 0.60 |
| ▸ | CA2 | P00918 | 1/20 | 0.52 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.47 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.47 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.47 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.47 |
| ▸ | CTSD | P07339 | 5/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL6448536 | 1.00 | CCR1 (0.60) | CCR1CA2OPRM1OPRK1TMEM97 | |
| SCHEMBL6447672 | 1.00 | CCR1 (0.60) | CCR1CA2OPRM1OPRK1TMEM97 | |
| SCHEMBL6446189 | 0.86 | CCR1 (0.53) | CCR1OPRM1OPRK1TMEM97SIGMAR1 | |
| SCHEMBL7299644 | 0.82 | CTSD (0.62) | CCR1OPRM1OPRK1TMEM97SIGMAR1 | |
| SCHEMBL29648527 | 0.81 | CA2 (0.66) | CA2CTSD | |
| SCHEMBL8853761 | 0.81 | CA2 (0.66) | CA2CTSD | |
| SCHEMBL6447454 | 0.81 | CA2 (0.66) | CA2CTSD | |
| SCHEMBL9233070 | 0.81 | CTSD (0.58) | CA2CTSD | |
| SCHEMBL6712577 | 0.80 | CCR1 (0.50) | CCR1 | |
| SCHEMBL6313523 | 0.79 | HDAC8 (0.56) | OPRM1OPRK1TMEM97SIGMAR1ALDH1A1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0839798-B1 | Intermediates for preparating non-peptide retroviral protease inhibitors | ABBOTT LAB (US) | 2005-08-17 | — | — | EP | disclosed |
| EP-0839798-A2 | Intermediates for preparating non-peptide retroviral protease inhibitors | ABBOTT LABORATORIES (US) | 1998-05-06 | — | — | EP | disclosed |
| US-5670675-A | Retroviral protease inhibiting compounds | ABBOTT LABORATORIES (US) | 1997-09-23 | — | — | US | disclosed |
| US-5142056-A | Human immunodeficiency virus protease inhibitor | ABBOTT LABORATORIES (US) | 1992-08-25 | — | — | US | disclosed |
| EP-0402646-A1 | Retroviral protease inhibiting compounds | ABBOTT LABORATORIES (US) | 1990-12-19 | — | — | EP | disclosed |