Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.59 |
| ▸ | GAA | P10253 | 3/20 | 0.59 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.59 |
| ▸ | HTT | P42858 | 2/20 | 0.59 |
| ▸ | TSHR | P16473 | 1/20 | 0.59 |
| ▸ | DHODH | Q02127 | 3/20 | 0.54 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 5/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | MC4R | P32245 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | PPARG | P37231 | 1/20 | 0.39 |
| ▸ | NCOA2 | Q15596 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL22577171 | 0.84 | ALDH1A1 (0.60) | ALDH1A1GAAHSD17B10HTTTSHR | |
| SCHEMBL3454855 | 0.82 | ALDH1A1 (0.61) | ALDH1A1GAAHSD17B10HTTTSHR | |
| SCHEMBL3454027 | 0.78 | ALDH1A1 (0.58) | ALDH1A1HSD17B10TSHRDHODHCYP1A2 | |
| SCHEMBL3332542 | 0.76 | ALDH1A1 (0.66) | ALDH1A1GAAHSD17B10CYP1A2HPGD | |
| SCHEMBL11157805 | 0.76 | ALDH1A1 (0.57) | ALDH1A1GAAHSD17B10HTTTSHR | |
| SCHEMBL26288487 | 0.75 | ALDH1A1 (0.47) | ALDH1A1GAAHSD17B10HTTCYP1A2 | |
| SCHEMBL5528079 | 0.74 | ALDH1A1 (0.56) | ALDH1A1GAAHSD17B10HTTTSHR | |
| SCHEMBL2873389 | 0.73 | ALDH1A1 (0.48) | ALDH1A1GAAHSD17B10HTTTSHR | |
| SCHEMBL5552417 | 0.72 | ALDH1A1 (0.46) | ALDH1A1GAAHSD17B10TSHRCYP1A2 | |
| SCHEMBL3454323 | 0.72 | ALDH1A1 (0.51) | ALDH1A1DHODHCYP1A2HPGDMAPT |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010007482-A2 | THIAZOLE DERIVATIVES AS STEAROYL COA DESATURASE INHIBITORS | GLENMARK PHARMACEUTICALS S.A. (CH) | 2010-01-21 | — | — | WO | disclosed |