Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NQO1 | P15559 | 3/20 | 0.72 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.56 |
| ▸ | MAPT | P10636 | 5/20 | 0.56 |
| ▸ | MEN1 | O00255 | 4/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.56 |
| ▸ | RAB9A | P51151 | 2/20 | 0.56 |
| ▸ | RECQL | P46063 | 1/20 | 0.56 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.56 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.56 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.56 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.56 |
| ▸ | PADI4 | Q9UM07 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.44 |
| ▸ | HSPD1 | P10809 | 2/20 | 0.44 |
| ▸ | HSPE1 | P61604 | 2/20 | 0.44 |
| ▸ | PKM | P14618 | 1/20 | 0.44 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.44 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.44 |
| ▸ | RELA | Q04206 | 1/20 | 0.44 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL7757057 | 0.84 | NQO1 (1.00) | NQO1KMT2AMAPTMEN1KDM4E | |
| SCHEMBL7757059 | 0.84 | NQO1 (1.00) | NQO1KMT2AMAPTMEN1KDM4E | |
| SCHEMBL30214865 | 0.80 | NQO1 (0.69) | NQO1KMT2AMAPTMEN1KDM4E | |
| SCHEMBL10362376 | 0.76 | NQO1 (0.85) | NQO1KMT2AMAPTMEN1KDM4E | |
| SCHEMBL10362375 | 0.76 | NQO1 (0.85) | NQO1KMT2AMAPTMEN1KDM4E | |
| SCHEMBL31419764 | 0.76 | NQO1 (0.85) | NQO1KMT2AMAPTMEN1KDM4E | |
| SCHEMBL28125674 | 0.75 | NQO1 (0.63) | NQO1KMT2AMAPTMEN1KDM4E | |
| SCHEMBL13100090 | 0.75 | NQO1 (0.81) | NQO1KMT2AMAPTMEN1KDM4E | |
| SCHEMBL30214929 | 0.73 | NFKB1 (0.48) | NQO1KMT2AMAPTMEN1KDM4E | |
| SCHEMBL8005054 | 0.73 | GAA (0.57) | MAPTKDM4EMAOBALDH1A1HPGD |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023027654-A1 | CARBOXYLIC ACID HYDRAZIDE-COUMARINE HYBRID COMPOUNDS ANTIINFLAMMATORY AND ANTICONVULSANE AGENT | CUKUROVA UNIVERSITESI REKTORLUGU (TR) | 2023-03-02 | — | — | WO | claimed |