Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 3/20 | 0.36 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | BACE1 | P56817 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.33 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | METAP2 | P50579 | 1/20 | 0.33 |
| ▸ | MAOB | P27338 | 1/20 | 0.32 |
| ▸ | TNKS | O95271 | 1/20 | 0.32 |
| ▸ | RPS6KA3 | P51812 | 1/20 | 0.32 |
| ▸ | GPR3 | P46089 | 1/20 | 0.32 |
| ▸ | MAP2K4 | P45985 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL5093327 | 0.84 | MAOB (0.35) | MAPTALDH1A1HPGDCYP2A6MAOB | |
| SCHEMBL434431 | 0.81 | L3MBTL1 (0.38) | ALDH1A1HPGDCYP2A6GPR3 | |
| SCHEMBL17697657 | 0.81 | NPC1 (0.37) | PTGS2HTTMAPTBACE1ALDH1A1 | |
| SCHEMBL15863475 | 0.78 | ALDH1A1 (0.39) | PTGS2BACE1ALDH1A1HSD17B10HPGD | |
| SCHEMBL2225126 | 0.78 | ALDH1A1 (0.38) | ALDH1A1MAPK1MAOBGPR3 | |
| SCHEMBL9138237 | 0.78 | HSD11B1 (0.41) | ALDH1A1HPGDCYP2A6MAPK1 | |
| SCHEMBL8129685 | 0.78 | PDE10A (0.36) | MAPTALDH1A1HSD17B10HPGDMAPK1 | |
| SCHEMBL6987826 | 0.75 | KDM4E (0.37) | ALDH1A1HSD17B10HPGDCYP2A6MAPK1 | |
| SCHEMBL7754420 | 0.75 | BACE1 (0.38) | PTGS2HTTBACE1ALDH1A1HSD17B10 | |
| SCHEMBL1205892 | 0.75 | TAAR1 (0.44) | MAPT |
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-6166072-A | Amino acid derivatives | ALLELIX NEUROSCIENCE, INC. (CA) | 2000-12-26 | — | — | US | disclosed |