Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 1/20 | 0.33 |
| ▸ | HTR1D | P28221 | 5/20 | 0.33 |
| ▸ | HTR1B | P28222 | 4/20 | 0.33 |
| ▸ | MTNR1A | P48039 | 4/20 | 0.32 |
| ▸ | MTNR1B | P49286 | 3/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | TRPV1 | Q8NER1 | 2/20 | 0.32 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | SPR | P35270 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL1051390 | 0.91 | ACHE (0.34) | ACHEHTR1DHTR1BMTNR1AMTNR1B | |
| SCHEMBL1050938 | 0.90 | HTR1D (0.37) | ACHEHTR1DHTR1BMTNR1AMTNR1B | |
| SCHEMBL5050472 | 0.84 | HTR1D (0.35) | HTR1DHTR1BMTNR1AMTNR1BKMT2A | |
| SCHEMBL1051032 | 0.84 | HTR1D (0.36) | ACHEHTR1DHTR1BMTNR1AMTNR1B | |
| SCHEMBL1049206 | 0.83 | HTR1D (0.36) | ACHEHTR1DHTR1BMTNR1AMTNR1B | |
| SCHEMBL1049543 | 0.82 | HTR1D (0.39) | HTR1DHTR1BMTNR1AMTNR1BTRPV1 | |
| Hydrochloric Acid SCHEMBL1049681 | 0.82 | HTR1D (0.39) | HTR1DHTR1BMTNR1AMTNR1BKMT2A | |
| SCHEMBL1049891 | 0.77 | MTNR1A (0.35) | MTNR1AMTNR1BKMT2ATRPV1PTGS2 | |
| Hydrochloric Acid SCHEMBL1050543 | 0.76 | TRPV1 (0.36) | HTR1DMTNR1AMTNR1BKMT2ATRPV1 | |
| SCHEMBL4533872 | 0.76 | HTR1D (0.31) | HTR1DHTR1B |
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 |
|---|---|---|---|---|---|---|---|
| US-7868036-B2 | Organic compounds | NOVARTIS AG (CH) | 2011-01-11 | — | — | US | disclosed |