Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR1 | P25103 | 4/20 | 0.35 |
| ▸ | NR1H2 | P55055 | 5/20 | 0.33 |
| ▸ | NR1H3 | Q13133 | 4/20 | 0.33 |
| ▸ | RXRA | P19793 | 2/20 | 0.33 |
| ▸ | USP30 | Q70CQ3 | 3/20 | 0.32 |
| ▸ | IDH1 | O75874 | 2/20 | 0.32 |
| ▸ | IDH2 | P48735 | 1/20 | 0.32 |
| ▸ | WNT3 | P56703 | 2/20 | 0.32 |
| ▸ | SFRP1 | Q8N474 | 2/20 | 0.32 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.32 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.31 |
| ▸ | KLK7 | P49862 | 1/20 | 0.31 |
| ▸ | UCHL1 | P09936 | 1/20 | 0.31 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.31 |
| ▸ | PDE11A | Q9HCR9 | 1/20 | 0.31 |
| ▸ | PDE10A | Q9Y233 | 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 | |
|---|---|---|---|---|
| SCHEMBL7916867 | 0.78 | JAK3 (0.43) | TACR1NR1H2NR1H3RXRAUSP30 | |
| SCHEMBL7909789 | 0.77 | JAK3 (0.36) | TACR1NR1H2NR1H3RXRAUSP30 | |
| SCHEMBL7922317 | 0.77 | HCRTR1 (0.37) | TACR1NR1H2NR1H3RXRAUSP30 | |
| SCHEMBL7919121 | 0.76 | TACR1 (0.36) | TACR1NR1H2NR1H3RXRAUSP30 | |
| SCHEMBL8148108 | 0.75 | PTGER1 (0.40) | TACR1RXRAKLK7 | |
| SCHEMBL5784642 | 0.75 | TACR1 (0.46) | TACR1NR1H2NR1H3RXRA | |
| SCHEMBL8125363 | 0.75 | TACR1 (0.46) | TACR1NR1H2NR1H3RXRA | |
| SCHEMBL8145216 | 0.74 | PTGS2 (0.35) | TACR1NR1H2NR1H3RXRAUSP30 | |
| SCHEMBL5785810 | 0.74 | TACR1 (0.50) | TACR1 | |
| SCHEMBL5784791 | 0.74 | KLK7 (0.41) | NR1H2NR1H3RXRAKLK7 |
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-6225320-B1 | TREATMENT OF PAIN, INFLAMMATION, MIGRAINE, EMESIS AND POSTTHERPETIC NEURALGIA | MERCK SHARP & DOHME LTD. (GB) | 2001-05-01 | — | — | US | disclosed |