Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.34 |
| ▸ | HPGD | P15428 | 4/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.34 |
| ▸ | MAPT | P10636 | 3/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | MGAM | O43451 | 3/20 | 0.34 |
| ▸ | GAA | P10253 | 3/20 | 0.34 |
| ▸ | SI | P14410 | 3/20 | 0.34 |
| ▸ | MGAM2 | Q2M2H8 | 3/20 | 0.34 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.34 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.34 |
| ▸ | UHRF1 | Q96T88 | 1/20 | 0.34 |
| ▸ | NQO2 | P16083 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | ATM | Q13315 | 1/20 | 0.32 |
| ▸ | PRKCB | P05771 | 1/20 | 0.32 |
| ▸ | PRKCA | P17252 | 1/20 | 0.32 |
| ▸ | PRKCH | P24723 | 1/20 | 0.32 |
| ▸ | PRKCE | Q02156 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL22011990 | 0.82 | ALDH1A1 (0.38) | ALDH1A1HPGDKDM4EMAPTNPSR1 | |
| SCHEMBL24171882 | 0.80 | ALDH1A1 (0.37) | ALDH1A1HPGDKDM4EMAPTNPSR1 | |
| SCHEMBL22012028 | 0.80 | MGAM (0.38) | ALDH1A1HPGDKDM4EMAPTNPSR1 | |
| SCHEMBL22013017 | 0.79 | ALDH1A1 (0.42) | ALDH1A1HPGDKDM4EMAPTNPSR1 | |
| SCHEMBL22012093 | 0.76 | ALDH1A1 (0.33) | ALDH1A1HPGDKDM4EMAPTNPSR1 | |
| SCHEMBL20152126 | 0.75 | ALDH1A1 (0.56) | ALDH1A1HPGDKDM4EMAPTNPSR1 | |
| SCHEMBL23822227 | 0.75 | ALDH1A1 (0.44) | ALDH1A1HPGDKDM4EMAPTNPSR1 | |
| SCHEMBL26468499 | 0.75 | ALDH1A1 (0.40) | ALDH1A1HPGDKDM4EMAPTNPSR1 | |
| SCHEMBL22011588 | 0.75 | MGAM (0.39) | ALDH1A1HPGDKDM4EMAPTNPSR1 | |
| SCHEMBL18926354 | 0.74 | ALDH1A1 (0.43) | ALDH1A1HPGDKDM4EMAPTNPSR1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3880682-B1 | MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES | MERCK PATENT GMBH (DE) | 2023-06-14 | — | — | EP | disclosed |