Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 5/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.38 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.37 |
| ▸ | GFER | P55789 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 4/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 3/20 | 0.36 |
| ▸ | STAT3 | P40763 | 2/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL6846968 | 0.72 | KMT2A (0.44) | ALDH1A1MAPTKDM4ESMN1; SMN2HTT | |
| SCHEMBL6841572 | 0.71 | KMT2A (0.50) | ALDH1A1MAPTKDM4ESMN1; SMN2HTT | |
| SCHEMBL6841492 | 0.68 | KMT2A (0.53) | ALDH1A1MAPTKDM4ESMN1; SMN2TDP1 | |
| SCHEMBL6841545 | 0.68 | KMT2A (0.53) | ALDH1A1MAPTKDM4ESMN1; SMN2TDP1 | |
| SCHEMBL1821903 | 0.67 | PTGDR2 (0.63) | ALDH1A1CYP1A2CYP2C9CYP2C19MAPT | |
| SCHEMBL6845567 | 0.66 | KMT2A (0.51) | ALDH1A1MAPTKDM4ESMN1; SMN2TDP1 | |
| SCHEMBL28530907 | 0.64 | ALDH1A1 (0.51) | ALDH1A1CYP1A2CYP2C9CYP2C19MAPT | |
| SCHEMBL3892825 | 0.63 | SRC (0.77) | — | |
| SCHEMBL6847129 | 0.61 | KMT2A (0.44) | ALDH1A1MAPTKDM4ESMN1; SMN2HTT | |
| SCHEMBL6846957 | 0.61 | GAK (0.40) | SMN1; SMN2HTTCYP3A4KMT2AL3MBTL1 |
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-1202992-B1 | ASCIDIDEMIN DERIVATIVES AND THEIR THERAPEUTIC APPLICATIONS | CEPHALON FRANCE (FR) | 2004-09-15 | — | — | EP | disclosed |
| EP-1202992-A2 | ASCIDIDEMIN DERIVATIVES AND THEIR THERAPEUTIC APPLICATIONS | LABORATOIRE L. LAFON (FR) | 2002-05-08 | — | — | EP | disclosed |
| WO-2001012631-A2 | ASCIDIDEMIN DERIVATIVES AND THEIR THERAPEUTIC APPLICATIONS | LABORATOIRE L. LAFON (FR) | 2001-02-22 | — | — | WO | disclosed |