Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASP1 | P29466 | 1/20 | 0.52 |
| ▸ | HTRA1 | Q92743 | 7/20 | 0.40 |
| ▸ | CASP3 | P42574 | 1/20 | 0.39 |
| ▸ | CTSL | P07711 | 1/20 | 0.38 |
| ▸ | CTSB | P07858 | 1/20 | 0.38 |
| ▸ | CTSF | Q9UBX1 | 1/20 | 0.38 |
| ▸ | ELANE | P08246 | 2/20 | 0.38 |
| ▸ | CTSD | P07339 | 2/20 | 0.37 |
| ▸ | ACE | P12821 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL7415572 | 0.87 | CASP1 (0.54) | CASP1HTRA1CASP3CTSBCTSD | |
| SCHEMBL7423261 | 0.84 | ELANE (0.47) | CASP1HTRA1CASP3ELANECTSD | |
| SCHEMBL7410781 | 0.83 | CASP1 (0.52) | CASP1CASP3CTSLCTSBELANE | |
| SCHEMBL7419381 | 0.79 | CASP1 (0.48) | CASP1CASP3CTSLCTSBELANE | |
| SCHEMBL7419148 | 0.77 | CTSL (0.49) | CASP1CTSLCTSBELANE | |
| SCHEMBL7411626 | 0.77 | CASP1 (0.47) | CASP1CASP3ELANE | |
| SCHEMBL7410782 | 0.75 | CASP1 (0.48) | CASP1HTRA1ELANE | |
| SCHEMBL9578947 | 0.75 | CA2 (0.47) | CASP1HTRA1CASP3CTSD | |
| SCHEMBL9579040 | 0.74 | CASP3 (0.46) | CASP1CASP3CTSLCTSBELANE | |
| SCHEMBL7413833 | 0.74 | CASP1 (0.47) | CASP1CTSLCTSBELANECTSD |
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 |
|---|---|---|---|---|---|---|---|
| WO-1992017176-A1 | RETROVIRAL PROTEASE INHIBITING COMPOUNDS | ABBOTT LABORATORIES (US) | 1992-10-15 | — | — | WO | claimed |
| US-5256677-A | Enzyme inhibitor for treating acquired immune deficiency syndrome | ABBOTT LABORATORIES (US) | 1993-10-26 | — | — | US | disclosed |
| WO-1992017176-A1 | RETROVIRAL PROTEASE INHIBITING COMPOUNDS | ABBOTT LABORATORIES (US) | 1992-10-15 | — | — | WO | disclosed |
| US-5151438-A | Enzyme inhibitors for treatment of aids | ABBOTT LABORATORIES (US) | 1992-09-29 | — | — | US | disclosed |