Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PHGDH | O43175 | 1/20 | 0.39 |
| ▸ | PIM1 | P11309 | 3/20 | 0.38 |
| ▸ | PIM3 | Q86V86 | 1/20 | 0.38 |
| ▸ | PIM2 | Q9P1W9 | 1/20 | 0.38 |
| ▸ | LCAT | P04180 | 1/20 | 0.37 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.34 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.34 |
| ▸ | HTR2C | P28335 | 1/20 | 0.34 |
| ▸ | AXL | P30530 | 1/20 | 0.34 |
| ▸ | HRH1 | P35367 | 1/20 | 0.34 |
| ▸ | HTR2B | P41595 | 1/20 | 0.34 |
| ▸ | HTR6 | P50406 | 1/20 | 0.34 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.34 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.34 |
| ▸ | SLC6A2 | P23975 | 4/20 | 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL30329091 | 0.99 | PHGDH (0.38) | PHGDHPIM1PIM3PIM2LCAT | |
| SCHEMBL30328241 | 0.86 | PIM1 (0.41) | PHGDHPIM1PIM3PIM2LCAT | |
| Hydrochloric Acid SCHEMBL30328885 | 0.85 | PIM1 (0.41) | PHGDHPIM1PIM3PIM2LCAT | |
| SCHEMBL30327738 | 0.80 | PIM1 (0.40) | PIM1PIM3PIM2MCHR1ALDH1A1 | |
| Hydrochloric Acid SCHEMBL30328028 | 0.79 | OGA (0.40) | PIM1PIM3PIM2MCHR1ALDH1A1 | |
| Hydrochloric Acid SCHEMBL30327910 | 0.79 | PIM1 (0.40) | PIM1PIM3PIM2MCHR1ALDH1A1 | |
| SCHEMBL2254829 | 0.76 | ADRB2 (0.51) | PHGDHLCATALDH1A1CYP1A2ADRB2 | |
| SCHEMBL20468848 | 0.74 | OGA (0.47) | PIM1MCHR1ALDH1A1HPGDHSD17B10 | |
| SCHEMBL20469193 | 0.74 | OGA (0.47) | PIM1PIM3PIM2MCHR1ALDH1A1 | |
| SCHEMBL30327830 | 0.72 | PIM1 (0.31) | PIM1PIM3PIM2ALDH1A1HPGD |
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-4415706-A1 | SMALL MOLECULE MODULATORS OF GLUCOCEREBROSIDASE ACTIVITY AND USES THEREOF | Vanqua Bio, Inc. (US) | 2024-08-21 | — | — | EP | disclosed |
| WO-2023064343-A1 | SMALL MOLECULE MODULATORS OF GLUCOCEREBROSIDASE ACTIVITY AND USES THEREOF | VANQUA BIO, INC. (US) | 2023-04-20 | — | — | WO | disclosed |