Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.47 |
| ▸ | RAB9A | P51151 | 3/20 | 0.47 |
| ▸ | PARP1 | P09874 | 2/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | ATM | Q13315 | 2/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | JAK2 | O60674 | 1/20 | 0.38 |
| ▸ | JAK1 | P23458 | 1/20 | 0.38 |
| ▸ | TYK2 | P29597 | 1/20 | 0.38 |
| ▸ | JAK3 | P52333 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL5710845 | 0.78 | NPC1 (0.51) | NPC1RAB9APARP1CYP1A2MEN1 | |
| SCHEMBL31309174 | 0.74 | PARP1 (0.39) | NPC1RAB9APARP1CYP1A2ATM | |
| SCHEMBL23950159 | 0.72 | PARP1 (0.37) | NPC1RAB9APARP1CYP1A2ATM | |
| SCHEMBL30273093 | 0.69 | PARP1 (0.54) | NPC1RAB9APARP1CYP1A2KMT2A | |
| SCHEMBL8480564 | 0.67 | JAK2 (0.51) | ATMNPSR1JAK2JAK1TYK2 | |
| SCHEMBL21851805 | 0.67 | ALDH1A1 (0.39) | NPC1RAB9ANPSR1MEN1KMT2A | |
| SCHEMBL4871941 | 0.66 | CYP1A2 (0.41) | NPC1RAB9APARP1CYP1A2MEN1 | |
| SCHEMBL3520851 | 0.66 | PDE3B (0.47) | KMT2AKDM4EALDH1A1HSD17B10HPGD | |
| SCHEMBL16506739 | 0.66 | PARP1 (0.68) | NPC1RAB9APARP1CYP1A2ADORA3 | |
| SCHEMBL18752187 | 0.66 | AKT2 (0.44) | NPC1RAB9ANPSR1MEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010059838-A2 | PDE4 INHIBITORS SELECTIVE FOR THE LONG FORM OF PDE4 FOR TREATING INFLAMMATION AND AVOIDING SIDE EFFECTS | DECODE GENETICS EHF (IS) | 2010-05-27 | — | — | WO | disclosed |
| WO-2010059836-A1 | SUBSTITUTED AZA-BRIDGED BICYCLICS FOR CARDIOVASCULAR AND CNS DISEASE | DECODE GENETICS EHF (IS) | 2010-05-27 | — | — | WO | disclosed |