Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DGAT1 | O75907 | 1/20 | 0.39 |
| ▸ | KDM1A | O60341 | 2/20 | 0.37 |
| ▸ | KDM1B | Q8NB78 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 5/20 | 0.34 |
| ▸ | NPC1 | O15118 | 3/20 | 0.34 |
| ▸ | RAB9A | P51151 | 3/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | HTT | P42858 | 2/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.32 |
| ▸ | PYCR1 | P32322 | 1/20 | 0.32 |
| ▸ | FLT1 | P17948 | 1/20 | 0.31 |
| ▸ | FLT4 | P35916 | 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 | |
|---|---|---|---|---|
| SCHEMBL1581643 | 0.77 | DGAT1 (0.39) | DGAT1KDM1AKDM1BLMNANPC1 | |
| SCHEMBL29504598 | 0.77 | DGAT1 (0.39) | DGAT1KDM1AKDM1BLMNANPC1 | |
| SCHEMBL18680828 | 0.76 | ALDH1A1 (0.42) | ALDH1A1MAPK14 | |
| SCHEMBL23912721 | 0.74 | CCR2 (0.39) | LMNARAB9ASMN1; SMN2KMT2AALDH1A1 | |
| SCHEMBL18247943 | 0.74 | PDE2A (0.44) | DGAT1KDM1AKDM1BLMNANPC1 | |
| SCHEMBL23912730 | 0.73 | NFE2L2 (0.36) | LMNANPC1RAB9ASMN1; SMN2KMT2A | |
| SCHEMBL19967188 | 0.73 | PKM (0.35) | NPC1RAB9ASMN1; SMN2KMT2AALDH1A1 | |
| SCHEMBL2102796 | 0.72 | LMNA (0.40) | DGAT1KDM1AKDM1BLMNANPC1 | |
| SCHEMBL2003379 | 0.72 | SLC6A2 (0.40) | DGAT1KDM1AKDM1BLMNANPC1 | |
| SCHEMBL31424259 | 0.72 | LMNA (0.40) | DGAT1KDM1AKDM1BLMNANPC1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3094325-B1 | HETEROARYLS AND USES THEREOF | TAKEDA PHARMACEUTICALS CO (JP) | 2021-10-13 | — | — | EP | disclosed |
| EP-2178858-B1 | NOVEL HETEROCYCLIC COMPOUNDS AS MGLU5 ANTAGONISTS | RECORDATI IRELAND LTD (IE) | 2011-12-28 | — | — | EP | disclosed |
| WO-2009015897-A1 | NOVEL HETEROCYCLIC COMPOUNDS AS MGLU5 ANTAGONISTS | RECORDATI IRELAND LIMITED (IE) | 2009-02-05 | — | — | WO | disclosed |