Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.44 |
| ▸ | POLB | P06746 | 3/20 | 0.39 |
| ▸ | MAPT | P10636 | 3/20 | 0.36 |
| ▸ | HTT | P42858 | 2/20 | 0.36 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | CA12 | O43570 | 1/20 | 0.35 |
| ▸ | CA1 | P00915 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | CA4 | P22748 | 1/20 | 0.35 |
| ▸ | CA7 | P43166 | 1/20 | 0.35 |
| ▸ | CA9 | Q16790 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | CES2 | O00748 | 1/20 | 0.33 |
| ▸ | CES1 | P23141 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL440880 | 0.82 | POLB (0.61) | ALDH1A1ALOX15POLBMAPTHPGD | |
| SCHEMBL10869194 | 0.81 | SIRT1 (0.55) | ALDH1A1POLBMAPTHPGDLMNA | |
| SCHEMBL11440098 | 0.80 | POLB (0.42) | ALDH1A1POLBMAPTHTTHPGD | |
| SCHEMBL11093143 | 0.79 | MAPT (0.37) | ALDH1A1ALOX15POLBMAPTHTT | |
| SCHEMBL28780147 | 0.78 | AKR1C3 (0.50) | ALDH1A1POLBMAPTHSP90AA1GAA | |
| SCHEMBL14744092 | 0.78 | POLB (0.41) | ALDH1A1ALOX15POLBMAPTHTT | |
| SCHEMBL9815789 | 0.77 | ALDH1A1 (0.52) | ALDH1A1ALOX15POLBMAPTHPGD | |
| SCHEMBL29378135 | 0.77 | POLB (0.64) | ALDH1A1ALOX15POLBMAPTHPGD | |
| SCHEMBL823696 | 0.77 | POLB (0.64) | ALDH1A1ALOX15POLBMAPTHPGD | |
| SCHEMBL11095215 | 0.77 | TSHR (0.39) | ALDH1A1ALOX15MAPTHTTHPGD |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101119963-B | Methamphetamine derivatives and conjugates for use in immunoassays | HOFFMANN LA ROCHE | 2013-01-02 | — | — | CN | disclosed |
| CN-101119963-A | Methamphetamine derivatives and conjugates for use in immunoassays | HOFFMANN LA ROCHE (CH) | 2008-02-06 | — | — | CN | disclosed |
| EP-1709019-A2 | THIAZOLE DERIVATIVES AND USE THEREOF | Applied Research Systems ARS Holding N.V. (AN) | 2006-10-11 | — | — | EP | disclosed |
| WO-2005068444-A2 | THIAZOLE DERIVATIVES AND USE THEREOF | APPLIED RESEARCH SYSTEMS ARS HOLDING N.V. (AN) | 2005-07-28 | — | — | WO | disclosed |