Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR1 | P25103 | 6/20 | 0.48 |
| ▸ | DPP4 | P27487 | 4/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.44 |
| ▸ | KCNA5 | P22460 | 1/20 | 0.44 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.42 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | KAT2B | Q92831 | 1/20 | 0.41 |
| ▸ | GLA | P06280 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL4686848 | 0.99 | TACR1 (0.49) | TACR1DPP4ALDH1A1HSD17B10TSHR | |
| SCHEMBL4686090 | 0.89 | TACR1 (0.49) | TACR1DPP4ALDH1A1KDM4EKCNH2 | |
| SCHEMBL4689195 | 0.87 | ALDH1A1 (0.48) | TACR1DPP4ALDH1A1HSD17B10TSHR | |
| SCHEMBL4685933 | 0.85 | KCNA5 (0.67) | TACR1DPP4ALDH1A1HSD17B10KDM4E | |
| SCHEMBL4689114 | 0.82 | ALDH1A1 (0.43) | TACR1DPP4ALDH1A1HSD17B10TSHR | |
| SCHEMBL8785517 | 0.77 | TACR1 (0.54) | TACR1DPP4KDM4EGAAMEN1 | |
| SCHEMBL5235622 | 0.77 | DPP4 (0.72) | TACR1DPP4KCNH2KCNA5 | |
| SCHEMBL8947816 | 0.74 | DPP4 (0.74) | TACR1DPP4MEN1KMT2AKCNH2 | |
| SCHEMBL8947966 | 0.74 | TACR1 (0.56) | TACR1DPP4MAPTKMT2AKCNH2 | |
| SCHEMBL2903883 | 0.74 | KCNA5 (0.66) | TACR1DPP4ALDH1A1KDM4EGAA |
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-1322619-B1 | ISOQUINOLINONE POTASSIUM CHANNEL INHIBITORS | MERCK & CO INC (US) | 2008-01-23 | — | — | EP | disclosed |
| US-6870055-B2 | Isoquinolinone potassium channels inhibitors | MERCK & CO., INC. (US) | 2005-03-22 | — | — | US | disclosed |