Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.40 |
| ▸ | HTT | P42858 | 4/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.33 |
| ▸ | RECQL | P46063 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | HTR1D | P28221 | 1/20 | 0.32 |
| ▸ | HTR1B | P28222 | 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 | |
|---|---|---|---|---|
| SCHEMBL7218144 | 0.86 | ALPL (0.46) | ALDH1A1HTTMAPTRAB9AL3MBTL1 | |
| SCHEMBL7218297 | 0.81 | POLB (0.44) | ALDH1A1HTTMAPTRAB9AL3MBTL1 | |
| SCHEMBL7219543 | 0.73 | ALDH1A1 (0.46) | ALDH1A1HTTMAPTRAB9AL3MBTL1 | |
| SCHEMBL7224192 | 0.72 | ALDH1A1 (0.47) | ALDH1A1HTTMAPTRAB9AKDM4E | |
| SCHEMBL9978844 | 0.70 | HDAC3 (0.44) | HTTMAPTRAB9AKDM4EHPGD | |
| SCHEMBL9979249 | 0.67 | TSHR (0.47) | ALDH1A1MAPTRAB9AL3MBTL1HPGD | |
| SCHEMBL9979163 | 0.67 | TSHR (0.47) | ALDH1A1HTTMAPTRAB9AL3MBTL1 | |
| SCHEMBL7217597 | 0.67 | ALDH1A1 (0.37) | ALDH1A1HTTMAPTRAB9AL3MBTL1 | |
| SCHEMBL7217716 | 0.67 | HTT (0.47) | ALDH1A1HTTMAPTRAB9AL3MBTL1 | |
| SCHEMBL2343577 | 0.66 | TSHR (0.41) | ALDH1A1RAB9AGAAHPGDTSHR |
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-6521603-B2 | Amide, thioamide, amidine and thioester derivatives containing a benzene, pyridine, thiophene, furan, pyrrole, pyrazole, thiazole or isothiazole ring | MONSANTO TECHNOLOGY LLC | 2003-02-18 | — | — | US | claimed |