Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SCD5 | Q86SK9 | 7/20 | 0.60 |
| ▸ | SCD | O00767 | 3/20 | 0.60 |
| ▸ | CPT2 | P23786 | 4/20 | 0.50 |
| ▸ | CPT1A | P50416 | 4/20 | 0.50 |
| ▸ | CPT1B | Q92523 | 1/20 | 0.47 |
| ▸ | USP30 | Q70CQ3 | 4/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.43 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.43 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.41 |
| ▸ | TRPV1 | Q8NER1 | 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 | |
|---|---|---|---|---|
| SCHEMBL3963506 | 1.00 | SCD5 (0.60) | SCD5SCDCPT2CPT1ACPT1B | |
| SCHEMBL3963503 | 0.87 | SCD5 (0.59) | SCD5SCDCPT2CPT1ACPT1B | |
| SCHEMBL3962393 | 0.86 | SCD5 (0.56) | SCD5SCDCPT2CPT1ACPT1B | |
| SCHEMBL3968500 | 0.86 | SCD5 (0.56) | SCD5SCDCPT2CPT1ACPT1B | |
| SCHEMBL5658667 | 0.84 | SCD5 (0.56) | SCD5SCDCPT2CPT1ACPT1B | |
| SCHEMBL5658662 | 0.84 | SCD5 (0.56) | SCD5SCDCPT2CPT1ACPT1B | |
| SCHEMBL5630003 | 0.83 | SCD5 (0.53) | SCD5SCDCPT2CPT1ACPT1B | |
| SCHEMBL4076414 | 0.83 | SCD5 (0.53) | SCD5SCDCPT2CPT1ACPT1B | |
| SCHEMBL2897851 | 0.83 | SCD5 (0.59) | SCD5SCDCPT2CPT1ACPT1B | |
| SCHEMBL2897853 | 0.83 | SCD5 (0.59) | SCD5SCDCPT2CPT1ACPT1B |
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-2027090-A2 | MGLUR5 MODULATORS II | AstraZeneca AB (SE) | 2009-02-25 | — | — | EP | claimed |
| WO-2007130821-A2 | MGLUR5 MODULATORS II | ASTRAZENECA AB (SE) | 2007-11-15 | — | — | WO | claimed |