Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PGR | P06401 | 2/20 | 0.39 |
| ▸ | PDE3B | Q13370 | 4/20 | 0.36 |
| ▸ | PDE3A | Q14432 | 4/20 | 0.36 |
| ▸ | CHUK | O15111 | 1/20 | 0.35 |
| ▸ | PKN1 | Q16512 | 1/20 | 0.32 |
| ▸ | PKN2 | Q16513 | 1/20 | 0.32 |
| ▸ | SYK | P43405 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | PIM1 | P11309 | 1/20 | 0.30 |
| ▸ | PIM3 | Q86V86 | 1/20 | 0.30 |
| ▸ | HIPK2 | Q9H2X6 | 1/20 | 0.30 |
| ▸ | DAO | P14920 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL6970313 | 0.79 | PGR (0.39) | PGRPDE3BPDE3ACHUKPKN1 | |
| SCHEMBL1010663 | 0.66 | ALDH1A1 (0.61) | PKN1PKN2MAPTALDH1A1LMNA | |
| SCHEMBL29674805 | 0.66 | ALDH1A1 (0.61) | PKN1PKN2MAPTALDH1A1LMNA | |
| SCHEMBL27415737 | 0.65 | ALDH1A1 (0.59) | PKN1PKN2MAPTALDH1A1LMNA | |
| Methane SCHEMBL27506999 | 0.65 | ALDH1A1 (0.59) | PKN1PKN2MAPTALDH1A1LMNA | |
| Bromide SCHEMBL11820178 | 0.65 | ALDH1A1 (0.59) | PKN1PKN2MAPTALDH1A1LMNA | |
| SCHEMBL8355731 | 0.65 | CYP3A4 (0.35) | MAPTLMNA | |
| Nitric Acid SCHEMBL6691619 | 0.63 | ALDH1A1 (0.56) | PKN1PKN2MAPTALDH1A1LMNA | |
| SCHEMBL6963305 | 0.63 | CMA1 (0.47) | PGRMAPTALDH1A1LMNA | |
| SCHEMBL11110839 | 0.63 | PGR (0.47) | PGRPDE3BPDE3AMAPTALDH1A1 |
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-0855391-B1 | NOVEL ISOQUINOLINE DERIVATIVES | DAIICHI SEIYAKU CO (JP) | 2003-10-15 | — | — | EP | disclosed |
| EP-0855391-A1 | NOVEL ISOQUINOLINE DERIVATIVES | SNOW BRAND MILK PRODUCTS CO., LTD. (JP) | 1998-07-29 | — | — | EP | disclosed |