Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 3/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.37 |
| ▸ | POLB | P06746 | 3/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | WNT3A | P56704 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL14740818 | 0.85 | STING1 (0.42) | HCAR2RAB9ATDP1ALDH1A1POLB | |
| SCHEMBL14740817 | 0.85 | POLB (0.45) | HCAR2RAB9AALDH1A1POLBNPC1 | |
| SCHEMBL14740770 | 0.83 | KCNQ4 (0.44) | ALDH1A1LMNAL3MBTL1MEN1KMT2A | |
| SCHEMBL27615916 | 0.75 | WNT3A (0.51) | WNT3A | |
| SCHEMBL27615861 | 0.74 | RAB9A (0.42) | RAB9AALDH1A1POLBNPC1SMN1; SMN2 | |
| SCHEMBL7469836 | 0.72 | MAOB (0.41) | RAB9AALDH1A1NPC1SMN1; SMN2LMNA | |
| SCHEMBL14740844 | 0.71 | MEN1 (0.43) | HCAR2TDP1POLBNPC1L3MBTL1 | |
| SCHEMBL7142468 | 0.70 | ALOX5AP (0.37) | RAB9ATDP1ALDH1A1POLBLMNA | |
| SCHEMBL14740813 | 0.70 | CCR2 (0.47) | ALDH1A1MEN1KMT2AMAPTCYP3A4 | |
| SCHEMBL14740837 | 0.70 | CYP17A1 (0.39) | RAB9AALDH1A1POLBNPC1MEN1 |
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-2751095-A2 | NOVEL BENZODIAZEPINONES AS MODULATORS OF METABOTROPIC GLUTAMATE RECEPTOR FUNCTIONS AND NEUROLOGICAL USES THEREOF | Sanford-Burnham Medical Research Institute (US) | 2014-07-09 | — | — | EP | disclosed |
| WO-2013033246-A2 | NOVEL BENZODIAZEPINONES AS MODULATORS OF METABOTROPIC GLUTAMATE RECEPTOR FUNCTIONS AND NEUROLOGICAL USES THEREOF | BRAINCELLS, INC. (US) | 2013-03-07 | — | — | WO | disclosed |