Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR6 | P50406 | 10/20 | 0.55 |
| ▸ | MEN1 | O00255 | 2/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | FABP4 | P15090 | 2/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.41 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.41 |
| ▸ | PPARG | P37231 | 2/20 | 0.40 |
| ▸ | PPARD | Q03181 | 2/20 | 0.40 |
| ▸ | PPARA | Q07869 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.38 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.38 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.38 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.38 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.38 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL6332940 | 0.86 | HTR6 (0.51) | HTR6CYP3A4PPARGPPARDPPARA | |
| SCHEMBL6328502 | 0.83 | HTR6 (0.40) | HTR6CYP3A4 | |
| SCHEMBL6338119 | 0.82 | HTR6 (0.61) | HTR6MEN1KMT2ACYP3A4FABP4 | |
| SCHEMBL6330490 | 0.74 | HTR6 (0.61) | HTR6MEN1KMT2ACYP3A4L3MBTL1 | |
| SCHEMBL1892670 | 0.73 | HTR6 (0.78) | HTR6MEN1KMT2ACYP3A4FABP4 | |
| SCHEMBL29559974 | 0.72 | MEN1 (1.00) | HTR6MEN1KMT2ACYP3A4FABP4 | |
| SCHEMBL10345778 | 0.72 | MEN1 (1.00) | HTR6MEN1KMT2ACYP3A4FABP4 | |
| SCHEMBL6331024 | 0.70 | HTR6 (0.52) | HTR6FABP4L3MBTL1KDM4E | |
| SCHEMBL3177100 | 0.68 | KCNH2 (0.43) | CYP3A4TSHR | |
| SCHEMBL6332254 | 0.68 | PNMT (0.52) | HTR6CYP3A4PPARGPPARDPPARA |
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-6849644-B2 | Isoquinoline derivatives useful in the treatment of CNS disorders | SMITHKLINE BEECHAM P.L.C. (GB) | 2005-02-01 | — | — | US | claimed |