Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB1 | P08588 | 2/20 | 0.54 |
| ▸ | HTR6 | P50406 | 4/20 | 0.47 |
| ▸ | TAS2R8 | Q9NYW2 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | CTSB | P07858 | 1/20 | 0.43 |
| ▸ | CTSS | P25774 | 1/20 | 0.43 |
| ▸ | CTSK | P43235 | 1/20 | 0.43 |
| ▸ | HTR1A | P08908 | 1/20 | 0.42 |
| ▸ | HTR1D | P28221 | 1/20 | 0.42 |
| ▸ | HTR2A | P28223 | 1/20 | 0.42 |
| ▸ | HTR2C | P28335 | 1/20 | 0.42 |
| ▸ | HTR7 | P34969 | 1/20 | 0.42 |
| ▸ | HTR2B | P41595 | 1/20 | 0.42 |
| ▸ | HTR3A | P46098 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 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 | |
|---|---|---|---|---|
| SCHEMBL22957172 | 0.84 | SIGMAR1 (0.50) | ADRB1HTR6HTR1AHTR2CHTR7 | |
| SCHEMBL6283138 | 0.82 | MEN1 (0.46) | ADRB1HTR6MEN1KMT2AALDH1A1 | |
| SCHEMBL6668632 | 0.82 | HDAC4 (0.40) | ADRB1HTR6MEN1KMT2AALDH1A1 | |
| SCHEMBL25583758 | 0.76 | ALDH1A1 (0.54) | TAS2R8MEN1POLBKMT2AALDH1A1 | |
| SCHEMBL6672808 | 0.76 | KDM1A (0.57) | MEN1KMT2AMAPT | |
| Trifluoroacetic Acid SCHEMBL30282920 | 0.75 | LMNA (0.45) | ADRB1POLBALDH1A1HTR3ATDP1 | |
| SCHEMBL593734 | 0.73 | SIGMAR1 (0.62) | ADRB1MEN1POLBKMT2AALDH1A1 | |
| SCHEMBL29756483 | 0.73 | SIGMAR1 (0.62) | ADRB1MEN1POLBKMT2AALDH1A1 | |
| SCHEMBL1703331 | 0.73 | MEN1 (0.68) | MEN1KMT2AALDH1A1MAPTTDP1 | |
| Hydrochloric Acid SCHEMBL2923966 | 0.72 | SIGMAR1 (0.61) | ADRB1MEN1POLBKMT2AALDH1A1 |
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-1373247-A2 | SPIROISOQUINOLINE COMPOUNDS, METHODS FOR THEIR PREPARATION AND INTERMEDIATES THEREOF | TANABE SEIYAKU CO., LTD. (JP) | 2004-01-02 | — | — | EP | disclosed |
| WO-2002079189-A2 | SPIROISOQUINOLINE COMPOUNDS, METHODS FOR THEIR PREPARATION AND INTERMEDIATES | TANABE SEIYAKU CO., LTD. (JP) | 2002-10-10 | — | — | WO | disclosed |