Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | CA7 | P43166 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.35 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.35 |
| ▸ | ACHE | P22303 | 1/20 | 0.35 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.35 |
| ▸ | TUBB | P07437 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL7387564 | 0.92 | MAPK1 (0.41) | ALDH1A1KDM4ESMN1; SMN2HSD17B10CYP1A2 | |
| SCHEMBL7385552 | 0.91 | ALDH1A1 (0.53) | ALDH1A1KDM4ESMN1; SMN2HSD17B10CYP1A2 | |
| SCHEMBL7384916 | 0.90 | MAPT (0.40) | ALDH1A1KDM4ESMN1; SMN2HSD17B10CYP1A2 | |
| SCHEMBL7384620 | 0.89 | MAPT (0.39) | ALDH1A1KDM4ESMN1; SMN2HSD17B10CYP1A2 | |
| SCHEMBL7376756 | 0.89 | AKR1B1 (0.43) | ALDH1A1KDM4ESMN1; SMN2HSD17B10HPGD | |
| SCHEMBL7386139 | 0.88 | KDM4E (0.39) | ALDH1A1KDM4EHSD17B10CYP1A2MEN1 | |
| SCHEMBL7381140 | 0.87 | ALDH1A1 (0.42) | ALDH1A1KDM4ESMN1; SMN2HSD17B10CYP1A2 | |
| SCHEMBL7386536 | 0.86 | NFKB1 (0.39) | ALDH1A1KDM4EMAPTTSHRTUBB4A | |
| SCHEMBL7383655 | 0.76 | BCHE (0.40) | ALDH1A1KDM4ESMN1; SMN2CA2HPGD | |
| SCHEMBL7385028 | 0.74 | AKR1B1 (0.43) | ALDH1A1KDM4ESMN1; SMN2HSD17B10HPGD |
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 |
|---|---|---|---|---|---|---|---|
| US-6486155-B1 | Method of inhibiting neoplastic cells with isoquinoline derivatives | CELL PATHWAYS INC | 2002-11-26 | — | — | US | disclosed |
| WO-1998038168-A1 | ISOQUINOLINONE DERIVATIVES, PROCESS FOR PREPARING THE SAME, AND THEIR USE AS PHOSPHODIESTERASE INHIBITORS | TANABE SEIYAKU CO., LTD. (JP) | 1998-09-03 | — | — | WO | disclosed |