Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 2/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
| ▸ | HTT | P42858 | 2/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 4/20 | 0.44 |
| ▸ | NPC1 | O15118 | 3/20 | 0.44 |
| ▸ | TP53 | P04637 | 2/20 | 0.44 |
| ▸ | RAB9A | P51151 | 2/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
| ▸ | GLA | P06280 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | MAOB | P27338 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | GAA | P10253 | 2/20 | 0.42 |
| ▸ | POLB | P06746 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | NAAA | Q02083 | 1/20 | 0.42 |
| ▸ | ADRA1D | P25100 | 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 | |
|---|---|---|---|---|
| SCHEMBL3674766 | 0.83 | NPC1 (0.46) | KMT2AHTTL3MBTL1HPGDNPC1 | |
| SCHEMBL4551863 | 0.83 | SCD5 (0.44) | MAPK1MEN1KMT2ATSHRL3MBTL1 | |
| SCHEMBL4551737 | 0.76 | KDM4E (0.54) | MEN1KMT2ATSHRL3MBTL1NPC1 | |
| SCHEMBL11994154 | 0.75 | CHRNB2 (0.64) | MAPK1MEN1KMT2AHTTTSHR | |
| SCHEMBL3673661 | 0.75 | BCAT2 (0.49) | TSHRHPGDNPC1RAB9AMAPT | |
| SCHEMBL4551961 | 0.74 | KMT2A (0.53) | MEN1KMT2ATSHRNPC1RAB9A | |
| SCHEMBL166777 | 0.70 | TSHR (0.62) | HTTTSHRL3MBTL1HPGDMAOB | |
| SCHEMBL31686014 | 0.70 | HPGD (0.64) | MAPK1MEN1KMT2AHTTTSHR | |
| SCHEMBL10158103 | 0.70 | HTT (0.68) | MAPK1KMT2AHTTTSHRL3MBTL1 | |
| SCHEMBL29315265 | 0.70 | TSHR (0.68) | HTTTSHRL3MBTL1HPGDMAOB |
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-2162136-A1 | BENZAMIDE MGLUR5 POSITIVE ALLOSTERIC MODULATORS AND METHODS OF MAKING AND USING SAME | VANDERBILT UNIVERSITY (US) | 2010-03-17 | — | — | EP | disclosed |
| WO-2008151184-A1 | BENZAMIDE MGLUR5 POSITIVE ALLOSTERIC MODULATORS AND METHODS OF MAKING AND USING SAME | VANDERBILT UNIVERSITY (US) | 2008-12-11 | — | — | WO | disclosed |