Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES1 | P23141 | 8/20 | 0.58 |
| ▸ | CES2 | O00748 | 7/20 | 0.58 |
| ▸ | HDAC3 | O15379 | 4/20 | 0.46 |
| ▸ | HDAC1 | Q13547 | 4/20 | 0.46 |
| ▸ | HDAC2 | Q92769 | 4/20 | 0.46 |
| ▸ | HDAC8 | Q9BY41 | 4/20 | 0.46 |
| ▸ | FFAR3 | O14843 | 3/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.36 |
| ▸ | CTSD | P07339 | 1/20 | 0.35 |
| ▸ | CA1 | P00915 | 1/20 | 0.35 |
| ▸ | HSD17B3 | P37058 | 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 | |
|---|---|---|---|---|
| SCHEMBL78456 | 0.84 | CES1 (0.62) | CES1CES2TSHRALDH1A1CA1 | |
| SCHEMBL5475220 | 0.82 | CES1 (0.64) | CES1CES2TSHRALDH1A1 | |
| SCHEMBL5514001 | 0.80 | CES2 (0.65) | CES1CES2TSHRALDH1A1 | |
| SCHEMBL4648044 | 0.78 | CES2 (0.30) | CES1CES2 | |
| SCHEMBL7219721 | 0.77 | FFAR3 (0.37) | CES1CES2HDAC3HDAC1HDAC2 | |
| SCHEMBL4641845 | 0.76 | — | — | |
| SCHEMBL10977744 | 0.76 | CES1 (0.55) | CES1CES2HDAC3HDAC1HDAC2 | |
| SCHEMBL108642 | 0.75 | CES1 (1.00) | CES1CES2HDAC3HDAC1HDAC2 | |
| SCHEMBL4645993 | 0.74 | CAMK2A (0.42) | CES1CES2 | |
| SCHEMBL28700622 | 0.74 | CES1 (0.52) | CES1CES2HDAC3HDAC1HDAC2 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1154986-B1 | PROCESS FOR THE PREPARATION OF IOPAMIDOL | BRACCO IMAGING SPA (IT) | 2004-06-09 | — | — | EP | claimed |
| CN-1177822-C | Novel bipyridyl derivatives | ��Э��ѧ��ʽ���� | 2004-12-01 | — | — | CN | disclosed |
| 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 |
| CN-1390202-A | Novel bipyridyl derivatives | SANKIO CHEMICAL CO LTD (JP) | 2003-01-08 | — | — | CN | disclosed |
| EP-1231207-A1 | NOVEL BIPYRIDYL DERIVATIVES | Sankio Chemical Co., Ltd. (JP) | 2002-08-14 | — | — | EP | disclosed |