Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.52 |
| ▸ | RAB9A | P51151 | 2/20 | 0.52 |
| ▸ | PAX8 | Q06710 | 2/20 | 0.52 |
| ▸ | JAK2 | O60674 | 1/20 | 0.52 |
| ▸ | MAPT | P10636 | 2/20 | 0.51 |
| ▸ | GAA | P10253 | 2/20 | 0.51 |
| ▸ | LMNA | P02545 | 1/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.51 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.51 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.46 |
| ▸ | TP53 | P04637 | 4/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.44 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | GPX4 | P36969 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL9051702 | 0.83 | NPC1 (0.57) | NPC1RAB9APAX8JAK2MAPT | |
| SCHEMBL8027230 | 0.77 | TP53 (0.53) | MAPTGAALMNASMN1; SMN2TP53 | |
| SCHEMBL4301694 | 0.76 | GAA (0.56) | NPC1RAB9APAX8JAK2MAPT | |
| SCHEMBL15291404 | 0.76 | ADRA2C (0.67) | NPC1RAB9APAX8JAK2MAPT | |
| SCHEMBL11506563 | 0.76 | ADRA2C (0.58) | NPC1RAB9APAX8JAK2MAPT | |
| SCHEMBL3055011 | 0.75 | NPC1 (0.65) | NPC1RAB9APAX8JAK2MAPT | |
| SCHEMBL14141689 | 0.75 | MAPT (0.52) | NPC1RAB9APAX8JAK2MAPT | |
| SCHEMBL894066 | 0.75 | NPC1 (0.69) | NPC1RAB9APAX8JAK2MAPT | |
| SCHEMBL10960951 | 0.75 | NPC1 (0.69) | NPC1RAB9APAX8JAK2MAPT | |
| SCHEMBL6424475 | 0.74 | NPC1 (0.68) | NPC1RAB9APAX8JAK2MAPT |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0722439-A1 | HIV PROTEASE INHIBITORS | AGOURON PHARMACEUTICALS, INC. (US) | 1996-07-24 | — | — | EP | disclosed |