Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 1/20 | 0.41 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | SYK | P43405 | 4/20 | 0.39 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.39 |
| ▸ | HTT | P42858 | 2/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | GRM5 | P41594 | 1/20 | 0.37 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.36 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.36 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.35 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.35 |
| ▸ | NOS1 | P29475 | 1/20 | 0.35 |
| ▸ | NOS2 | P35228 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.34 |
| ▸ | USP2 | O75604 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL2229954 | 0.80 | KDM4E (0.41) | KDM4EMAPTSYKCYP3A4NR4A2 | |
| SCHEMBL2229343 | 0.80 | ADRB2 (0.44) | KDM4EMAPTSYKHTTCYP3A4 | |
| SCHEMBL2231397 | 0.79 | KDM4E (0.40) | KDM4EMAPTSYKRAB9ACYP3A4 | |
| SCHEMBL3141121 | 0.78 | CYP3A4 (0.54) | HTTNPC1RAB9APDE10APDGFRB | |
| SCHEMBL1056691 | 0.77 | NPC1 (0.42) | MAOADYRK1AKDM4EMAPTSYK | |
| SCHEMBL13369864 | 0.77 | KDM4E (0.42) | MAOAKDM4EMAPTHTTRAB9A | |
| SCHEMBL8602761 | 0.75 | MAOA (0.46) | MAOADYRK1ANPC1SLC22A12NOS1 | |
| SCHEMBL3136961 | 0.74 | ALDH1A1 (0.53) | KDM4EMAPTHTTNPC1RAB9A | |
| SCHEMBL2230568 | 0.74 | ALDH1A1 (0.56) | KDM4EMAPTSYKNPC1CYP3A4 | |
| SCHEMBL31731760 | 0.71 | MAOA (0.46) | MAOADYRK1ASLC22A12CYP3A4ALOX15 |
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-2512478-A1 | HOMOGENEOUS SUSPENSION OF IMMUNOPOTENTIATING COMPOUNDS AND USES THEREOF | Novartis AG (CH) | 2012-10-24 | — | — | EP | disclosed |
| WO-2011084549-A1 | HOMOGENEOUS SUSPENSION OF IMMUNOPOTENTIATING COMPOUNDS AND USES THEREOF | NOVARTIS AG (CH) | 2011-07-14 | — | — | WO | disclosed |