Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSD | P07339 | 4/20 | 0.57 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.51 |
| ▸ | CA2 | P00918 | 1/20 | 0.47 |
| ▸ | PSMB11 | A5LHX3 | 5/20 | 0.46 |
| ▸ | PSMA7 | O14818 | 5/20 | 0.46 |
| ▸ | PSMB1 | P20618 | 5/20 | 0.46 |
| ▸ | PSMA1 | P25786 | 5/20 | 0.46 |
| ▸ | PSMA2 | P25787 | 5/20 | 0.46 |
| ▸ | PSMA3 | P25788 | 5/20 | 0.46 |
| ▸ | PSMA4 | P25789 | 5/20 | 0.46 |
| ▸ | PSMB8 | P28062 | 5/20 | 0.46 |
| ▸ | PSMB9 | P28065 | 5/20 | 0.46 |
| ▸ | PSMA5 | P28066 | 5/20 | 0.46 |
| ▸ | PSMB4 | P28070 | 5/20 | 0.46 |
| ▸ | PSMB6 | P28072 | 5/20 | 0.46 |
| ▸ | PSMB5 | P28074 | 5/20 | 0.46 |
| ▸ | PSMB10 | P40306 | 5/20 | 0.46 |
| ▸ | PSMB3 | P49720 | 5/20 | 0.46 |
| ▸ | PSMB2 | P49721 | 5/20 | 0.46 |
| ▸ | PSMA6 | P60900 | 5/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL7268971 | 0.94 | CTSD (0.63) | CTSDCYP3A4CA2CTSLCTSB | |
| SCHEMBL7275770 | 0.93 | CTSD (0.65) | CTSDCYP3A4CA2CTSLCTSB | |
| SCHEMBL6449478 | 0.93 | CTSD (0.63) | CTSDCYP3A4CA2CTSLCTSB | |
| SCHEMBL6448343 | 0.93 | CTSD (0.63) | CTSDCYP3A4CA2CTSLCTSB | |
| SCHEMBL6446319 | 0.93 | CTSD (0.63) | CTSDCYP3A4CA2CTSLCTSB | |
| SCHEMBL6447685 | 0.87 | CTSD (0.57) | CTSDCYP3A4CA2CTSLCTSB | |
| SCHEMBL6446462 | 0.86 | CTSD (0.56) | CTSDCYP3A4 | |
| SCHEMBL7268683 | 0.86 | CTSD (0.65) | CTSDCYP3A4CA2PSMB11PSMA7 | |
| SCHEMBL7279498 | 0.85 | CTSD (0.60) | CTSDCYP3A4CA2GPR132 | |
| SCHEMBL7336336 | 0.85 | CA2 (0.60) | CTSDCYP3A4CA2CTSLCTSB |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0997459-A1 | Intermediates for preparing retroviral protease inhibiting compounds | Abbott Laboratories (US) | 2000-05-03 | — | — | EP | disclosed |
| US-5648497-A | Retroviral protease inhibiting compounds | ABBOTT LABORAOTRIES (US) | 1997-07-15 | — | — | US | disclosed |
| US-5616714-A | PYRIDYL, THIAZOLYL-SUBSTITUTED AMINO ACID DERIVATIVES | ABBOTT LABORATORIES (US) | 1997-04-01 | — | — | US | disclosed |
| US-5541334-A | TREATING HIV | ABBOTT LABORATORIES (US) | 1996-07-30 | — | — | US | disclosed |
| US-5354866-A | Treating HIV infections | ABBOTT LABORATORIES (US) | 1994-10-11 | — | — | US | disclosed |
| EP-0486948-A2 | Retroviral protease inhibiting compounds | ABBOTT LABORATORIES (US) | 1992-05-27 | — | — | EP | disclosed |