Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM2 | Q14416 | 1/20 | 0.36 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.36 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.36 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.36 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.36 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | PRKCI | P41743 | 1/20 | 0.33 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.33 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.33 |
| ▸ | ACHE | P22303 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 3/20 | 0.32 |
| ▸ | GAA | P10253 | 2/20 | 0.32 |
| ▸ | RAD52 | P43351 | 2/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | GFER | P55789 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL30182580 | 1.00 | GRM2 (0.36) | GRM2NR1H2ADRB2ADRB1ADRB3 | |
| SCHEMBL6682105 | 0.90 | PRKCI (0.37) | GRM2NR1H2ADRB2ADRB1ADRB3 | |
| SCHEMBL6674369 | 0.87 | PRKCI (0.41) | GRM2NR1H2ALDH1A1PRKCIEPHX2 | |
| SCHEMBL12569696 | 0.85 | PRKCI (0.38) | GRM2NR1H2ALDH1A1PRKCIEPHX2 | |
| SCHEMBL24891924 | 0.84 | TKT (0.36) | NR1H2ADRB2ADRB1ADRB3PDE10A | |
| SCHEMBL6675964 | 0.83 | HTR2A (0.40) | GRM2NR1H2PRKCIEPHX2NR1H4 | |
| SCHEMBL6675419 | 0.83 | GRM2 (0.40) | GRM2NR1H2PRKCIACHEAAK1 | |
| SCHEMBL7246662 | 0.82 | GAA (0.36) | GRM2NR1H2PRKCIACHEMAPT | |
| SCHEMBL6675380 | 0.81 | AAK1 (0.37) | GRM2NR1H2PRKCIEPHX2NR1H4 | |
| SCHEMBL18172845 | 0.80 | TSHR (0.40) | ALDH1A1ACHETSHRMAPK1HTT |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023287736-A1 | NOVEL BIS-AMIDE CONTAINING COMPOUNDS EXHIBITING ANTIFUNGAL ACTIVITY AND THEIR METHOD OF USE | FOX CHASE CHEMICAL DIVERSITY CENTER, INC. (US) | 2023-01-19 | — | — | WO | disclosed |
| WO-2023287736-A1 | NOVEL BIS-AMIDE CONTAINING COMPOUNDS EXHIBITING ANTIFUNGAL ACTIVITY AND THEIR METHOD OF USE | FOX CHASE CHEMICAL DIVERSITY CENTER, INC. (US) | 2023-01-19 | — | — | WO | disclosed |