Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 6/20 | 0.41 |
| ▸ | RXFP1 | Q9HBX9 | 5/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.40 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL197114 | 0.89 | MAPT (0.49) | MAPTMEN1KMT2ACYP1A2TP53 | |
| SCHEMBL959150 | 0.86 | MEN1 (0.48) | MAPTRXFP1MEN1KMT2AGAA | |
| SCHEMBL196682 | 0.86 | IGF1R (0.49) | MAPTRXFP1NPY5RTRPV1TP53 | |
| SCHEMBL196310 | 0.84 | RXFP1 (0.47) | MAPTRXFP1KMT2AGAATP53 | |
| SCHEMBL196780 | 0.78 | GRM4 (0.51) | MAPTRXFP1GAATP53NPC1 | |
| SCHEMBL29501836 | 0.78 | GRM4 (0.51) | MAPTRXFP1GAATP53NPC1 | |
| SCHEMBL30637139 | 0.78 | GRM4 (0.51) | MAPTRXFP1GAATP53NPC1 | |
| SCHEMBL196377 | 0.77 | GRM4 (0.49) | MAPTRXFP1GAATP53NPC1 | |
| SCHEMBL196452 | 0.77 | GRM4 (0.47) | MAPTRXFP1TP53NPC1RAB9A | |
| SCHEMBL936460 | 0.76 | NPC1 (0.58) | MAPTMEN1KMT2ANPY5RTP53 |
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 |
|---|---|---|---|---|---|---|---|
| JP-2012500255-A | — | — | 2012-01-05 | — | — | JP | claimed |
| EP-2323661-A1 | A3 ADENOSINE RECEPTOR ALLOSTERIC MODULATORS | Universiteit Leiden (NL) | 2011-05-25 | — | — | EP | claimed |
| WO-2010020981-A1 | A3 ADENOSINE RECEPTOR ALLOSTERIC MODULATORS | UNIVERSITEIT LEIDEN (NL) | 2010-02-25 | — | — | WO | claimed |