Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 5/20 | 0.49 |
| ▸ | ERBB2 | P04626 | 5/20 | 0.49 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.40 |
| ▸ | BCHE | P06276 | 1/20 | 0.38 |
| ▸ | ACHE | P22303 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | MAOB | P27338 | 1/20 | 0.37 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.35 |
| ▸ | CA12 | O43570 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
| ▸ | CA9 | Q16790 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.34 |
| ▸ | CA7 | P43166 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL29957305 | 0.88 | CYP19A1 (0.42) | CYP19A1BCHEACHECA12CYP1A2 | |
| SCHEMBL29954466 | 0.84 | PNMT (0.44) | CYP19A1BCHEACHETP53CYP1A2 | |
| SCHEMBL29953134 | 0.84 | ALDH1A1 (0.43) | CYP19A1BCHEACHETP53MAOB | |
| SCHEMBL29951413 | 0.83 | EGFR (0.45) | EGFRERBB2BCHEACHEKMT2A | |
| SCHEMBL1307134 | 0.83 | CA2 (0.48) | BCHEACHEKMT2AMEN1CA12 | |
| SCHEMBL29950734 | 0.81 | GAA (0.41) | BCHEACHEKMT2AMEN1CA12 | |
| SCHEMBL29953416 | 0.81 | HTR2A (0.48) | BCHEACHETP53KMT2AMEN1 | |
| SCHEMBL29954825 | 0.81 | BCHE (0.42) | CYP19A1BCHEACHETP53KMT2A | |
| SCHEMBL29955878 | 0.75 | ACHE (0.49) | EGFRERBB2BCHEACHEKMT2A | |
| SCHEMBL29958124 | 0.75 | BCHE (0.49) | EGFRERBB2BCHEACHEKMT2A |
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 |
|---|---|---|---|---|---|---|---|
| US-20220340893-A1 | BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES | NUEVOLUTION A/S (DK) | 2022-10-27 | — | — | US | disclosed |