Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.69 |
| ▸ | TSHR | P16473 | 2/20 | 0.67 |
| ▸ | MEN1 | O00255 | 1/20 | 0.67 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.67 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.67 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.67 |
| ▸ | HTT | P42858 | 1/20 | 0.67 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.67 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.67 |
| ▸ | HSD11B1 | P28845 | 8/20 | 0.58 |
| ▸ | USP2 | O75604 | 1/20 | 0.56 |
| ▸ | LMNA | P02545 | 1/20 | 0.56 |
| ▸ | HPGD | P15428 | 1/20 | 0.51 |
| ▸ | PDE2A | O00408 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL4645685 | 1.00 | NPC1 (0.69) | NPC1TSHRMEN1CYP3A4CYP2C9 | |
| SCHEMBL4648430 | 0.90 | NPC1 (0.67) | NPC1TSHRMEN1CYP3A4CYP2C9 | |
| SCHEMBL4648423 | 0.90 | NPC1 (0.67) | NPC1TSHRMEN1CYP3A4CYP2C9 | |
| SCHEMBL4647096 | 0.89 | HSD11B1 (0.72) | NPC1TSHRMEN1CYP3A4CYP2C9 | |
| SCHEMBL4647105 | 0.89 | HSD11B1 (0.72) | NPC1TSHRMEN1CYP3A4CYP2C9 | |
| SCHEMBL4649006 | 0.87 | HSD11B1 (0.57) | NPC1TSHRMEN1CYP3A4CYP2C9 | |
| SCHEMBL4649008 | 0.87 | HSD11B1 (0.57) | NPC1TSHRMEN1CYP3A4CYP2C9 | |
| SCHEMBL3137493 | 0.86 | ALDH1A1 (0.66) | NPC1TSHRMEN1HTTKMT2A | |
| SCHEMBL3137500 | 0.86 | ALDH1A1 (0.66) | NPC1TSHRMEN1HTTKMT2A | |
| SCHEMBL4646170 | 0.85 | HSD11B1 (0.60) | NPC1TSHRMEN1HTTKMT2A |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1896464-A1 | NOVEL HETEROCYCLIC COMPOUNDS AS POSITIVE ALLOSTERIC MODULATORS OF METABOTROPIC GLUTAMATE RECEPTORS | Addex Pharma SA (CH) | 2008-03-12 | — | — | EP | claimed |
| WO-2006129199-A1 | NOVEL HETEROCYCLIC COMPOUNDS AS POSITIVE ALLOSTERIC MODULATORS OF METABOTROPIC GLUTAMATE RECEPTORS | ADDEX PHARMA SA (CH) | 2006-12-07 | — | — | WO | claimed |
| EP-1896464-A1 | NOVEL HETEROCYCLIC COMPOUNDS AS POSITIVE ALLOSTERIC MODULATORS OF METABOTROPIC GLUTAMATE RECEPTORS | Addex Pharma SA (CH) | 2008-03-12 | — | — | EP | disclosed |
| WO-2006129199-A1 | NOVEL HETEROCYCLIC COMPOUNDS AS POSITIVE ALLOSTERIC MODULATORS OF METABOTROPIC GLUTAMATE RECEPTORS | ADDEX PHARMA SA (CH) | 2006-12-07 | — | — | WO | disclosed |