Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 9/20 | 0.58 |
| ▸ | CES1 | P23141 | 9/20 | 0.58 |
| ▸ | LMNA | P02545 | 4/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | XBP1 | P17861 | 1/20 | 0.44 |
| ▸ | ATM | Q13315 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 2/20 | 0.42 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.42 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | PGR | P06401 | 1/20 | 0.41 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.41 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.41 |
| ▸ | HTR2A | P28223 | 1/20 | 0.41 |
| ▸ | HRH1 | P35367 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL963849 | 0.82 | TSHR (0.53) | CES2CES1LMNASMN1; SMN2MAPT | |
| SCHEMBL29162946 | 0.77 | CES2 (0.57) | CES2CES1LMNASMN1; SMN2MAPT | |
| SCHEMBL30354594 | 0.76 | LMNA (0.47) | CES2CES1LMNASMN1; SMN2MAPT | |
| SCHEMBL27844978 | 0.75 | CES2 (0.52) | CES2CES1LMNASMN1; SMN2MAPT | |
| SCHEMBL5034585 | 0.75 | MAOA (0.40) | LMNASMN1; SMN2MAPTALDH1A1HPGD | |
| SCHEMBL27667390 | 0.74 | L3MBTL1 (0.51) | CES2CES1LMNASMN1; SMN2MAPT | |
| SCHEMBL21517648 | 0.74 | CES2 (1.00) | CES2CES1LMNASMN1; SMN2MAPT | |
| SCHEMBL7669290 | 0.73 | CES2 (1.00) | CES2CES1LMNASMN1; SMN2MAPT | |
| SCHEMBL1300587 | 0.73 | TSHR (0.44) | NPSR1SLC6A3HTR2AHRH1 | |
| SCHEMBL4625390 | 0.73 | CES2 (1.00) | CES2CES1LMNASMN1; SMN2MAPT |
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 |
|---|---|---|---|---|---|---|---|
| US-6603007-B1 | Intermediates in the fields of pharmaceuticals, agrichemicals, ligands, silver halide photosensitive materials, liquid crystals, surfactants, electrophotography and organic electroluminescence | SANKIO CHEMICAL CO., LTD. (JP) | 2003-08-05 | — | — | US | disclosed |
| EP-1231207-A1 | NOVEL BIPYRIDYL DERIVATIVES | Sankio Chemical Co., Ltd. (JP) | 2002-08-14 | — | — | EP | disclosed |