Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | GAA | P10253 | 3/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | THRB | P10828 | 2/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL8650932 | 0.90 | NPC1 (0.42) | KMT2AMEN1ALDH1A1GAAMAPT | |
| SCHEMBL8644322 | 0.89 | MAPT (0.42) | KMT2AMEN1ALDH1A1GAAMAPT | |
| SCHEMBL8648671 | 0.87 | KMT2A (0.47) | KMT2AMEN1ALDH1A1GAAMAPT | |
| SCHEMBL8646761 | 0.87 | CYP3A4 (0.45) | KMT2AMEN1ALDH1A1MAPTKDM4E | |
| SCHEMBL8643707 | 0.85 | KMT2A (0.50) | KMT2AMEN1ALDH1A1GAAMAPT | |
| SCHEMBL8647153 | 0.84 | CYP1A1 (0.47) | KMT2AMEN1ALDH1A1GAAMAPT | |
| SCHEMBL8650931 | 0.82 | ATM (0.37) | ALDH1A1GAAMAPTKDM4ELMNA | |
| SCHEMBL8648668 | 0.81 | ALDH1A1 (0.35) | KMT2AMEN1ALDH1A1MAPTTDP1 | |
| SCHEMBL8646248 | 0.81 | MAPT (0.43) | KMT2AMEN1ALDH1A1MAPTKDM4E | |
| SCHEMBL8647072 | 0.79 | ALDH1A1 (0.52) | KMT2AMEN1ALDH1A1GAALMNA |
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-0861831-A1 | HETEROARYL-SUBSTITUTED ACRYLOYLGUANIDINE DERIVATIVES AND MEDICINAL COMPOSITION THEREOF | YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) | 1998-09-02 | — | — | EP | disclosed |