Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TNKS2 | Q9H2K2 | 2/20 | 0.49 |
| ▸ | PARP2 | Q9UGN5 | 2/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | TSHR | P16473 | 2/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | MDH2 | P40926 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.42 |
| ▸ | GABRG2 | P18507 | 2/20 | 0.42 |
| ▸ | GABRB3 | P28472 | 2/20 | 0.42 |
| ▸ | GABRA5 | P31644 | 2/20 | 0.42 |
| ▸ | GABRA3 | P34903 | 2/20 | 0.42 |
| ▸ | GABRA2 | P47869 | 2/20 | 0.42 |
| ▸ | CTSV | O60911 | 1/20 | 0.41 |
| ▸ | CTSL | P07711 | 1/20 | 0.41 |
| ▸ | MAOB | P27338 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL4078619 | 0.96 | TNKS2 (0.47) | TNKS2PARP2ALDH1A1TSHRCYP3A4 | |
| SCHEMBL4079118 | 0.85 | ALDH1A1 (0.42) | TNKS2ALDH1A1TSHRL3MBTL1HPGD | |
| SCHEMBL4071315 | 0.84 | PARP15 (0.43) | TNKS2PARP2ALDH1A1L3MBTL1HPGD | |
| SCHEMBL4070289 | 0.83 | PARP15 (0.45) | TNKS2PARP2ALDH1A1TSHRL3MBTL1 | |
| SCHEMBL4070068 | 0.80 | ELANE (0.42) | TNKS2PARP2ALDH1A1L3MBTL1HPGD | |
| SCHEMBL6226036 | 0.79 | PARP15 (0.42) | TNKS2PARP2ALDH1A1TSHRL3MBTL1 | |
| SCHEMBL4255377 | 0.78 | L3MBTL1 (0.42) | ALDH1A1TSHRCYP3A4MAPK1TDP1 | |
| SCHEMBL4071784 | 0.76 | EGLN1 (0.41) | ALDH1A1TSHRCYP3A4MAPK1TDP1 | |
| SCHEMBL8147522 | 0.75 | TNKS2 (0.60) | TNKS2PARP2ALDH1A1TSHRHPGD | |
| SCHEMBL8133930 | 0.72 | GPR17 (0.50) | TNKS2ALDH1A1TSHRL3MBTL1HPGD |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1538160-B1 | Substituted Isoquinolin-3-carboxyamides, their preparation and medical use | FIBROGEN INC (US) | 2009-06-03 | — | — | EP | disclosed |
| EP-0911340-B1 | Substituted Isoquinolin-3-Carboxyamides, their preparation and medical use | FIBROGEN INC (US) | 2005-07-06 | — | — | EP | disclosed |
| EP-0911340-A2 | Substituted Isoquinolin-3-Carboxyamides, their preparation and medical use | Hoechst Marion Roussel Deutschland GmbH (DE) | 1999-04-28 | — | — | EP | disclosed |