Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 5/20 | 0.40 |
| ▸ | MAPT | P10636 | 4/20 | 0.40 |
| ▸ | RAB9A | P51151 | 4/20 | 0.40 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.38 |
| ▸ | PRMT6 | Q96LA8 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.36 |
| ▸ | IDH1 | O75874 | 6/20 | 0.34 |
| ▸ | IDH2 | P48735 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | MGLL | Q99685 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.32 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL4061700 | 0.70 | NPC1 (0.43) | NPC1MAPTRAB9APDE10APRMT6 | |
| SCHEMBL5250342 | 0.69 | MAPT (0.41) | NPC1MAPTRAB9ANPSR1KDM4E | |
| SCHEMBL1094013 | 0.67 | NPC1 (0.63) | NPC1MAPTRAB9APRMT6NPSR1 | |
| SCHEMBL5802745 | 0.66 | ADRB2 (0.43) | NPC1MAPTRAB9APDE10APRMT6 | |
| SCHEMBL30552781 | 0.66 | PRMT6 (0.45) | NPC1MAPTRAB9APDE10APRMT6 | |
| SCHEMBL5545937 | 0.64 | PRMT6 (0.42) | NPC1MAPTRAB9APRMT6NPSR1 | |
| SCHEMBL1230980 | 0.64 | ALDH1A1 (0.31) | MAPTALDH1A1 | |
| SCHEMBL3724060 | 0.64 | IDH1 (0.31) | MAPTIDH1ALDH1A1 | |
| SCHEMBL4434312 | 0.64 | MAPT (0.43) | NPC1MAPTRAB9APRMT6NPSR1 | |
| SCHEMBL4429679 | 0.64 | PRMT6 (0.43) | NPC1MAPTRAB9APDE10APRMT6 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2461811-A1 | MACROCYCLIC SERINE PROTEASE INHIBITORS USEFUL AGAINST VIRAL INFECTIONS, PARTICULARLY HCV | IDENIX Pharmaceuticals, Inc. (US) | 2012-06-13 | — | — | EP | disclosed |
| WO-2011017389-A1 | MACROCYCLIC SERINE PROTEASE INHIBITORS USEFUL AGAINST VIRAL INFECTIONS, PARTICULARLY HCV | IDENIX PHARMACEUTICALS, INC. (US) | 2011-02-10 | — | — | WO | disclosed |