Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TYMP | P19971 | 4/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.35 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.35 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.33 |
| ▸ | GSK3B | P49841 | 1/20 | 0.33 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.32 |
| ▸ | PARP1 | P09874 | 1/20 | 0.32 |
| ▸ | DDAH1 | O94760 | 1/20 | 0.32 |
| ▸ | CRHR1 | P34998 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL3103281 | 0.80 | TYMP (0.39) | TYMPGAAALDH1A1MAPK1L3MBTL1 | |
| SCHEMBL28882429 | 0.78 | ALDH1A1 (0.37) | GAAALDH1A1MAPK1ADORA3ADORA2A | |
| SCHEMBL27807973 | 0.78 | TYMP (0.42) | TYMPALDH1A1MAPK1L3MBTL1GSK3B | |
| SCHEMBL3205670 | 0.78 | ALDH1A1 (0.41) | TYMPALDH1A1MAPK1GSK3BPARP1 | |
| SCHEMBL13384270 | 0.75 | ALDH1A1 (0.39) | TYMPALDH1A1MAPK1GSK3BPARP1 | |
| SCHEMBL7275316 | 0.73 | ALDH1A1 (0.44) | ALDH1A1MAPK1PARP1HSD17B10 | |
| SCHEMBL7626256 | 0.72 | ALDH1A1 (0.46) | TYMPALDH1A1MAPK1GSK3BPARP1 | |
| SCHEMBL11226357 | 0.72 | GPR84 (0.42) | ALDH1A1ADORA3ADORA2AADORA1 | |
| SCHEMBL14743462 | 0.71 | ALDH1A1 (0.44) | TYMPALDH1A1MAPK1PARP1 | |
| SCHEMBL13891112 | 0.69 | — | — |
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-101780949-B | Method for preparing multi-walled carbon nano-tube | INSTITUTE OF CHEMISTRY, CHINESE ACADEMY OF SCIENCES (CN) | 2011-12-07 | — | — | CN | disclosed |
| CN-101780949-A | Method for preparing multi-walled carbon nano-tube | CHINESE ACAD INST CHEMISTRY | 2010-07-21 | — | — | CN | disclosed |