Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PNMT | P11086 | 1/20 | 0.44 |
| ▸ | PGR | P06401 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.40 |
| ▸ | CTSV | O60911 | 1/20 | 0.39 |
| ▸ | CTSL | P07711 | 1/20 | 0.39 |
| ▸ | CTSB | P07858 | 1/20 | 0.39 |
| ▸ | CTSS | P25774 | 1/20 | 0.39 |
| ▸ | CTSK | P43235 | 1/20 | 0.39 |
| ▸ | RGS4 | P49798 | 1/20 | 0.39 |
| ▸ | RGS8 | P57771 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | THRB | P10828 | 1/20 | 0.39 |
| ▸ | BCHE | P06276 | 1/20 | 0.39 |
| ▸ | ACHE | P22303 | 1/20 | 0.39 |
| ▸ | KDM1A | O60341 | 1/20 | 0.39 |
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) | PGRALDH1A1MAPTTDP1CYP19A1 | |
| SCHEMBL29955518 | 0.84 | EGFR (0.49) | ALDH1A1MAPTCYP19A1TP53BCHE | |
| SCHEMBL29953134 | 0.84 | ALDH1A1 (0.43) | ALDH1A1MAPTCYP19A1TP53BCHE | |
| SCHEMBL29958124 | 0.83 | BCHE (0.49) | ALDH1A1MAPTLMNABCHEACHE | |
| SCHEMBL1307134 | 0.83 | CA2 (0.48) | ALDH1A1MAPTBCHEACHECYP1A2 | |
| SCHEMBL29950734 | 0.81 | GAA (0.41) | ALDH1A1TDP1BCHEACHECYP3A4 | |
| SCHEMBL29954825 | 0.81 | BCHE (0.42) | ALDH1A1MAPTCYP19A1TP53BCHE | |
| SCHEMBL29953416 | 0.81 | HTR2A (0.48) | ALDH1A1MAPTALOX12LMNATP53 | |
| SCHEMBL29955878 | 0.75 | ACHE (0.49) | ALDH1A1MAPTLMNABCHEACHE | |
| SCHEMBL29951413 | 0.75 | EGFR (0.45) | ALDH1A1TDP1BCHEACHECYP1A2 |
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 |