Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.49 |
| ▸ | HPGD | P15428 | 5/20 | 0.49 |
| ▸ | HTT | P42858 | 3/20 | 0.48 |
| ▸ | LMNA | P02545 | 7/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | GAA | P10253 | 2/20 | 0.42 |
| ▸ | MAPT | P10636 | 4/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.38 |
| ▸ | RHEB | Q15382 | 1/20 | 0.38 |
| ▸ | APEX1 | P27695 | 1/20 | 0.38 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.37 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.37 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.36 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.36 |
| ▸ | ACLY | P53396 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL6445991 | 1.00 | ALDH1A1 (0.49) | ALDH1A1HPGDHTTLMNAKMT2A | |
| SCHEMBL6445990 | 1.00 | ALDH1A1 (0.49) | ALDH1A1HPGDHTTLMNAKMT2A | |
| SCHEMBL6442833 | 0.85 | GRIN2D (0.42) | ALDH1A1HPGDHTTLMNAKMT2A | |
| SCHEMBL6442838 | 0.85 | GRIN2D (0.42) | ALDH1A1HPGDHTTLMNAKMT2A | |
| SCHEMBL6448723 | 0.82 | LMNA (0.47) | ALDH1A1HPGDLMNAKMT2AGAA | |
| SCHEMBL5270990 | 0.81 | SMN1; SMN2 (0.41) | ALDH1A1HPGDHTTLMNAKMT2A | |
| SCHEMBL5270996 | 0.81 | SMN1; SMN2 (0.41) | ALDH1A1HPGDHTTLMNAKMT2A | |
| SCHEMBL5269701 | 0.79 | MAPT (0.49) | ALDH1A1HPGDHTTLMNAKMT2A | |
| SCHEMBL5269703 | 0.79 | MAPT (0.49) | ALDH1A1HPGDHTTLMNAKMT2A | |
| SCHEMBL5269698 | 0.79 | MAPT (0.49) | ALDH1A1HPGDHTTLMNAKMT2A |
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-6894190-B2 | Process for producing optically active 3,3,3-trifluoro-2-hydroxy-2-methylpropionic acid, and salt thereof | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2005-05-17 | — | — | US | disclosed |