Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | LTA4H | P09960 | 2/20 | 0.38 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.38 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.38 |
| ▸ | HTR1A | P08908 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | HRH2 | P25021 | 4/20 | 0.35 |
| ▸ | HRH1 | P35367 | 4/20 | 0.35 |
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | CA12 | O43570 | 1/20 | 0.34 |
| ▸ | CA1 | P00915 | 1/20 | 0.34 |
| ▸ | CA2 | P00918 | 1/20 | 0.34 |
| ▸ | CA9 | Q16790 | 1/20 | 0.34 |
| ▸ | BCHE | P06276 | 1/20 | 0.33 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL2762111 | 0.85 | ALDH1A1 (0.44) | ALDH1A1LTA4HPDCD1CD274HTR1A | |
| SCHEMBL2762058 | 0.85 | ALDH1A1 (0.44) | ALDH1A1LTA4HPDCD1CD274HTR1A | |
| SCHEMBL2762016 | 0.85 | ALDH1A1 (0.44) | ALDH1A1LTA4HPDCD1CD274HTR1A | |
| Hydrochloric Acid SCHEMBL914515 | 0.84 | GNAI3 (0.43) | ALDH1A1LTA4HPDCD1CD274HTR1A | |
| SCHEMBL10867737 | 0.82 | PDCD1 (0.43) | ALDH1A1LTA4HPDCD1CD274HTR1A | |
| SCHEMBL28960037 | 0.82 | PDCD1 (0.44) | ALDH1A1LTA4HPDCD1CD274HTR1A | |
| SCHEMBL18838073 | 0.79 | ALDH1A1 (0.38) | ALDH1A1LTA4HKDM4EHRH2HRH1 | |
| SCHEMBL22671983 | 0.79 | ALDH1A1 (0.38) | ALDH1A1LTA4HKDM4EHRH2HRH1 | |
| Hydrochloric Acid SCHEMBL22654993 | 0.77 | ALDH1A1 (0.38) | ALDH1A1KDM4EHRH2HRH1SMN1; SMN2 | |
| SCHEMBL2762050 | 0.77 | GNAI3 (0.43) | ALDH1A1KDM4EHRH3TSHR |
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 |
|---|---|---|---|---|---|---|---|
| WO-2024148029-A2 | ORGANIC COMPOUNDS AS NLRP3 INHIBITORS | KODIAK SCIENCES INC. (US) | 2024-07-11 | — | — | WO | disclosed |