Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.58 |
| ▸ | RAB9A | P51151 | 3/20 | 0.58 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.58 |
| ▸ | LMNA | P02545 | 1/20 | 0.58 |
| ▸ | ADAMTS4 | O75173 | 1/20 | 0.53 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | PGR | P06401 | 1/20 | 0.47 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.47 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.47 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.47 |
| ▸ | ELANE | P08246 | 2/20 | 0.47 |
| ▸ | TYR | P14679 | 1/20 | 0.46 |
| ▸ | ECE1 | P42892 | 2/20 | 0.44 |
| ▸ | MME | P08473 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | CTSL | P07711 | 1/20 | 0.44 |
| ▸ | CTSB | P07858 | 1/20 | 0.44 |
| ▸ | CTSS | P25774 | 1/20 | 0.44 |
| ▸ | CTSK | P43235 | 1/20 | 0.44 |
| ▸ | PTPRA | P18433 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL6445930 | 1.00 | NPC1 (0.58) | NPC1RAB9ASMN1; SMN2LMNAADAMTS4 | |
| SCHEMBL3033874 | 0.99 | NPC1 (0.59) | NPC1RAB9ASMN1; SMN2LMNAADAMTS4 | |
| SCHEMBL4675990 | 0.99 | NPC1 (0.59) | NPC1RAB9ASMN1; SMN2LMNAADAMTS4 | |
| SCHEMBL3029779 | 0.88 | NPC1 (0.56) | NPC1RAB9ASMN1; SMN2LMNAADAMTS4 | |
| SCHEMBL4680818 | 0.88 | NPC1 (0.56) | NPC1RAB9ASMN1; SMN2LMNAADAMTS4 | |
| SCHEMBL7310548 | 0.88 | RAB9A (0.55) | NPC1RAB9ASMN1; SMN2LMNAADAMTS4 | |
| SCHEMBL7310554 | 0.88 | RAB9A (0.55) | NPC1RAB9ASMN1; SMN2LMNAADAMTS4 | |
| Lithium Ion SCHEMBL6445927 | 0.86 | SMN1; SMN2 (0.53) | NPC1RAB9ASMN1; SMN2LMNAADAMTS4 | |
| SCHEMBL6841163 | 0.84 | SMN1; SMN2 (0.59) | NPC1RAB9ASMN1; SMN2LMNAADAMTS4 | |
| SCHEMBL6841164 | 0.84 | SMN1; SMN2 (0.59) | NPC1RAB9ASMN1; SMN2LMNAADAMTS4 |
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-0839798-B1 | Intermediates for preparating non-peptide retroviral protease inhibitors | ABBOTT LAB (US) | 2005-08-17 | — | — | EP | disclosed |
| EP-0402646-B1 | Retroviral protease inhibiting compounds | ABBOTT LAB (US) | 1998-07-22 | — | — | EP | disclosed |
| EP-0839798-A2 | Intermediates for preparating non-peptide retroviral protease inhibitors | ABBOTT LABORATORIES (US) | 1998-05-06 | — | — | EP | disclosed |
| US-5545750-A | TREATING HUMAN IMMUNODEFICIENCY VIRUS | ABBOTT LABORATORIES (US) | 1996-08-13 | — | — | 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 |