Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 5/20 | 0.56 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.48 |
| ▸ | MAPT | P10636 | 2/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 4/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.44 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.42 |
| ▸ | NPC1 | O15118 | 3/20 | 0.42 |
| ▸ | RAB9A | P51151 | 3/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.42 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.42 |
| ▸ | RELA | Q04206 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL16672388 | 0.86 | CREBBP (0.55) | GAACREBBPALDH1A1MAPTMEN1 | |
| SCHEMBL16672363 | 0.86 | CREBBP (0.55) | GAACREBBPALDH1A1MAPTPOLB | |
| SCHEMBL20726674 | 0.85 | CREBBP (0.45) | GAACREBBPALDH1A1MAPTMEN1 | |
| SCHEMBL20726631 | 0.83 | PTGS2 (0.57) | GAACREBBPALDH1A1MAPTPOLB | |
| SCHEMBL16672411 | 0.83 | CREBBP (0.52) | GAACREBBPMAPTRXFP1SMN1; SMN2 | |
| SCHEMBL16672420 | 0.83 | CREBBP (0.52) | CREBBPALDH1A1MAPTMEN1KMT2A | |
| SCHEMBL16672412 | 0.81 | CREBBP (0.49) | GAACREBBPALDH1A1MAPTMEN1 | |
| SCHEMBL20726645 | 0.80 | GAA (0.52) | GAAMAPTPOLBCYP1A2CYP3A4 | |
| SCHEMBL16672352 | 0.79 | MAP2K2 (0.48) | GAACREBBPALDH1A1MAPTPOLB | |
| SCHEMBL16672326 | 0.79 | MAPT (0.47) | GAACREBBPALDH1A1MAPTPOLB |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3060549-B1 | NOVEL ANTIFUNGAL OXODIHYDROPYRIDINECARBOHYDRAZIDE DERIVATIVE | DAE WOONG PHARMA (KR) | 2019-02-13 | — | — | EP | disclosed |