Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.62 |
| ▸ | HPGD | P15428 | 3/20 | 0.62 |
| ▸ | LMNA | P02545 | 4/20 | 0.59 |
| ▸ | CA1 | P00915 | 1/20 | 0.48 |
| ▸ | CA2 | P00918 | 1/20 | 0.48 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.45 |
| ▸ | P2RX4 | Q99571 | 1/20 | 0.45 |
| ▸ | KCNA5 | P22460 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.43 |
| ▸ | GAA | P10253 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 5/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 4/20 | 0.41 |
| ▸ | NTSR1 | P30989 | 1/20 | 0.41 |
| ▸ | MITF | O75030 | 2/20 | 0.41 |
| ▸ | TP53 | P04637 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| Aniline SCHEMBL28203025 | 0.90 | ALDH1A1 (0.61) | ALDH1A1HPGDLMNACA1CA2 | |
| SCHEMBL96535 | 0.85 | ALDH1A1 (0.50) | ALDH1A1HPGDLMNACA1CA2 | |
| SCHEMBL2633946 | 0.85 | ALDH1A1 (0.50) | ALDH1A1HPGDLMNACA1CA2 | |
| SCHEMBL29527952 | 0.79 | ALDH1A1 (0.60) | ALDH1A1HPGDLMNACA1CA2 | |
| SCHEMBL3467222 | 0.78 | ALDH1A1 (0.50) | ALDH1A1HPGDLMNACA1CA2 | |
| 1,2,3,4-Tetrahydroisoquinoline SCHEMBL27560136 | 0.78 | ALDH1A1 (0.47) | ALDH1A1HPGDLMNACA1CA2 | |
| SCHEMBL9439646 | 0.77 | ALDH1A1 (0.58) | ALDH1A1HPGDLMNACA1CA2 | |
| Meradimate SCHEMBL18884 | 0.76 | ALDH1A1 (1.00) | ALDH1A1HPGDLMNACA1CA2 | |
| Meradimate SCHEMBL18989595 | 0.76 | ALDH1A1 (1.00) | ALDH1A1HPGDLMNACA1CA2 | |
| Meradimate SCHEMBL6851307 | 0.76 | ALDH1A1 (1.00) | ALDH1A1HPGDLMNACA1CA2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-101323610-B | Preparation of trityl group candesartan cilexetil intermediate | HENGDIAN GROUP CHENGDU MOLECULAR LAB | 2013-10-30 | — | — | CN | disclosed |
| CN-101323610-A | Novel preparation of trityl group candesartan cilexetil intermediate | HENGDIAN GROUP CHENGDU MOLECUL (CN) | 2008-12-17 | — | — | CN | disclosed |