Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.48 |
| ▸ | RAB9A | P51151 | 2/20 | 0.48 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | ABCB1 | P08183 | 3/20 | 0.45 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.45 |
| ▸ | HTR1A | P08908 | 5/20 | 0.44 |
| ▸ | ADRA1D | P25100 | 4/20 | 0.44 |
| ▸ | ADRA1A | P35348 | 4/20 | 0.44 |
| ▸ | ADRA1B | P35368 | 4/20 | 0.44 |
| ▸ | DRD2 | P14416 | 1/20 | 0.44 |
| ▸ | LIPE | Q05469 | 1/20 | 0.43 |
| ▸ | PTGER1 | P34995 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.42 |
| ▸ | BCHE | P06276 | 2/20 | 0.42 |
| ▸ | RXRA | P19793 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL28862953 | 0.82 | NPC1 (0.56) | NPC1RAB9AMAPTMAPK1TDP1 | |
| SCHEMBL23536856 | 0.80 | PTGER1 (0.60) | NPC1RAB9AMAPTMAPK1TDP1 | |
| SCHEMBL17912878 | 0.79 | MAPT (0.66) | MAPTMAPK1TDP1L3MBTL1ABCB1 | |
| SCHEMBL30445162 | 0.78 | HTR1A (0.58) | MAPTMAPK1TDP1L3MBTL1ABCB1 | |
| SCHEMBL11019947 | 0.78 | HTR1A (0.58) | MAPTMAPK1TDP1L3MBTL1ABCB1 | |
| SCHEMBL29930885 | 0.78 | NPC1 (0.60) | NPC1RAB9APTGER1HPGDSMN1; SMN2 | |
| SCHEMBL23611725 | 0.78 | NPC1 (0.60) | NPC1RAB9APTGER1HPGDSMN1; SMN2 | |
| SCHEMBL6312645 | 0.76 | HTR1A (0.63) | NPC1RAB9AMAPTMAPK1TDP1 | |
| SCHEMBL23611722 | 0.76 | NPC1 (0.68) | NPC1RAB9AMAPTL3MBTL1PTGER1 | |
| SCHEMBL29930700 | 0.76 | NPC1 (0.68) | NPC1RAB9AMAPTL3MBTL1PTGER1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2004073638-A2 | METHOD OF LOWERING BODY TEMPERATURE WITH (S)-2,3-BENZODIAZEPINES | VELA PHARMACEUTICALS, INC. (US) | 2004-09-02 | — | — | WO | disclosed |