Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 4/20 | 0.58 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.58 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.58 |
| ▸ | NFKB1 | P19838 | 3/20 | 0.58 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.58 |
| ▸ | TP53 | P04637 | 2/20 | 0.58 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.58 |
| ▸ | MYLK | Q15746 | 2/20 | 0.58 |
| ▸ | MEN1 | O00255 | 1/20 | 0.58 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.58 |
| ▸ | MAPT | P10636 | 4/20 | 0.56 |
| ▸ | LMNA | P02545 | 4/20 | 0.56 |
| ▸ | GMNN | O75496 | 2/20 | 0.56 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.56 |
| ▸ | TSHR | P16473 | 3/20 | 0.54 |
| ▸ | USP2 | O75604 | 1/20 | 0.51 |
| ▸ | HTR6 | P50406 | 2/20 | 0.50 |
| ▸ | PKLR | P30613 | 1/20 | 0.49 |
| ▸ | THPO | P40225 | 1/20 | 0.48 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL30610303 | 0.83 | USP2 (0.66) | CYP3A4MAPK1KMT2ANFKB1CYP1A2 | |
| SCHEMBL654111 | 0.83 | USP2 (0.66) | CYP3A4MAPK1KMT2ANFKB1CYP1A2 | |
| SCHEMBL3244492 | 0.78 | CYP3A4 (0.74) | CYP3A4MAPK1KMT2ANFKB1CYP1A2 | |
| SCHEMBL2959421 | 0.75 | POLB (0.57) | CYP3A4MAPK1KMT2ANFKB1CYP1A2 | |
| SCHEMBL16026638 | 0.75 | MAPT (0.59) | CYP3A4MAPK1KMT2ANFKB1CYP1A2 | |
| SCHEMBL8475920 | 0.74 | HTR6 (0.47) | CYP3A4MAPK1KMT2ANFKB1CYP1A2 | |
| SCHEMBL2869228 | 0.73 | CYP3A4 (1.00) | CYP3A4MAPK1KMT2ANFKB1CYP1A2 | |
| SCHEMBL2960623 | 0.73 | MEN1 (0.71) | CYP3A4MAPK1KMT2ANFKB1CYP1A2 | |
| Hydrochloric Acid SCHEMBL1848494 | 0.72 | MAPK1 (1.00) | CYP3A4MAPK1KMT2ANFKB1CYP1A2 | |
| Hydrochloric Acid SCHEMBL29370764 | 0.72 | MAPK1 (1.00) | CYP3A4MAPK1KMT2ANFKB1CYP1A2 |
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-0783500-A1 | AMINOHETEROCYCLIC DERIVATIVES AS ANTITHROMBOTIC OR ANTICOAGULANT AGENTS | ZENECA LIMITED (GB) | 1997-07-16 | — | — | EP | disclosed |
| WO-1996010022-A1 | AMINOHETEROCYCLIC DERIVATIVES AS ANTITHROMBOTIC OR ANTICOAGULANT AGENTS | ZENECA LIMITED (GB) | 1996-04-04 | — | — | WO | disclosed |