Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.48 |
| ▸ | F2 | P00734 | 4/20 | 0.45 |
| ▸ | MAPK10 | P53779 | 5/20 | 0.41 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.41 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 3/20 | 0.41 |
| ▸ | POLB | P06746 | 2/20 | 0.41 |
| ▸ | TYMS | P04818 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL7215317 | 1.00 | ALDH1A1 (0.48) | ALDH1A1F2MAPK10MAPK9MAPK14 | |
| SCHEMBL6724939 | 0.92 | ALDH1A1 (0.48) | ALDH1A1F2MAPK10MAPK9MAPK14 | |
| SCHEMBL6724942 | 0.92 | ALDH1A1 (0.48) | ALDH1A1F2MAPK10MAPK9MAPK14 | |
| SCHEMBL6720406 | 0.90 | KMT2A (0.46) | ALDH1A1F2MAPK10LMNAPOLB | |
| SCHEMBL6720407 | 0.90 | KMT2A (0.46) | ALDH1A1F2MAPK10LMNAPOLB | |
| SCHEMBL6724884 | 0.89 | ALDH1A1 (0.53) | ALDH1A1F2LMNAPOLBTYMS | |
| SCHEMBL6724887 | 0.89 | ALDH1A1 (0.53) | ALDH1A1F2LMNAPOLBTYMS | |
| SCHEMBL6720541 | 0.89 | KMT2A (0.49) | ALDH1A1F2MAPK10LMNAPOLB | |
| SCHEMBL6720539 | 0.89 | KMT2A (0.49) | ALDH1A1F2MAPK10LMNAPOLB | |
| SCHEMBL6720531 | 0.86 | ALDH1A1 (0.46) | ALDH1A1F2LMNAPOLBTYMS |
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-1337515-A1 | (DIHYDRO)ISOQUINOLINE DERIVATIVES AS PHOSPHODIESTERASE INHIBITORS | Byk Gulden Lomberg Chemische Fabrik GmbH (DE) | 2003-08-27 | — | — | EP | disclosed |
| WO-2002040450-A1 | (DIHYDRO)ISOQUINOLINE DERIVATIVES AS PHOSPHODIESTERASE INHIBITORS | ALTANA PHARMA AG (DE) | 2002-05-23 | — | — | WO | disclosed |