Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2E1 | P05181 | 4/20 | 0.47 |
| ▸ | CYP2C8 | P10632 | 4/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.47 |
| ▸ | CYP2A6 | P11509 | 4/20 | 0.47 |
| ▸ | CYP2B6 | P20813 | 4/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.47 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.41 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.41 |
| ▸ | CCNC | P24863 | 1/20 | 0.40 |
| ▸ | CDK8 | P49336 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.37 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.37 |
| ▸ | SLC22A12 | Q96S37 | 2/20 | 0.36 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL7215542 | 0.89 | L3MBTL1 (0.40) | CYP2E1CYP2C8CYP2D6CYP2A6CYP2B6 | |
| SCHEMBL6626248 | 0.85 | CYP2E1 (0.59) | CYP2E1CYP2C8CYP2D6CYP2A6CYP2B6 | |
| SCHEMBL4544610 | 0.85 | CCNC (0.49) | CYP2E1CYP2C8CYP2D6CYP2A6CYP2B6 | |
| SCHEMBL15467814 | 0.81 | HTT (0.40) | CCNCCDK8HTTKMT2AMEN1 | |
| SCHEMBL25092615 | 0.81 | KMT2A (0.39) | CYP2E1CYP2C8CYP2D6CYP2A6CYP2B6 | |
| SCHEMBL11374174 | 0.77 | HTR1A (0.43) | CDK8HTTNCOA3CYP19A1ALDH1A1 | |
| SCHEMBL3074174 | 0.77 | HTT (0.42) | CCNCCDK8HTTKMT2AMEN1 | |
| SCHEMBL23674615 | 0.77 | HTT (0.42) | CCNCCDK8HTTKMT2AMEN1 | |
| SCHEMBL7662114 | 0.77 | HTT (0.42) | CYP2E1CYP2C8CYP2D6CYP2A6CYP2B6 | |
| SCHEMBL23517169 | 0.76 | KMT2A (0.41) | CYP2E1CYP2C8CYP2D6CYP2A6CYP2B6 |
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 13 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117185998-B | Preparation method of 2-propylthioisonicotinamide | 苏州开元民生科技股份有限公司 | 2024-01-05 | — | — | CN | disclosed |
| CN-117185998-A | Preparation method of 2-propylthioisonicotinamide | 苏州开元民生科技股份有限公司 | 2023-12-08 | — | — | CN | disclosed |
| CN-114105869-B | Preparation method of 2-propyl-4-cyanopyridine | 苏州开元民生科技股份有限公司 | 2022-11-08 | — | — | CN | disclosed |
| CN-114105869-B | Preparation method of 2-propyl-4-cyanopyridine | 苏州开元民生科技股份有限公司 | 2022-11-08 | — | — | CN | disclosed |
| CN-114105869-A | Preparation method of 2-propyl-4-cyanopyridine | 苏州开元民生科技股份有限公司 | 2022-03-01 | — | — | CN | disclosed |
| CN-114105869-A | Preparation method of 2-propyl-4-cyanopyridine | 苏州开元民生科技股份有限公司 | 2022-03-01 | — | — | CN | disclosed |
| WO-2011040629-A1 | COMPOSITION AND METHOD FOR CONTROLLING ARTHROPOD PESTS | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2011-04-07 | — | — | WO | 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 |
| EP-1231207-A1 | NOVEL BIPYRIDYL DERIVATIVES | Sankio Chemical Co., Ltd. (JP) | 2002-08-14 | — | — | EP | disclosed |
| US-4260759-A | CONDENSATION OF NITRILES | SCHERING-CORPORATION (US) | 1981-04-07 | — | — | US | disclosed |
| US-4115395-A | FUNGICIDES, BACTERICIDES | SCHERING CORPORATION (US) | 1978-09-19 | — | — | US | disclosed |
| US-4107166-A | ANTIFUNGAL, ANTIBACTERIAL | SCHERING CORPORATION (US) | 1978-08-15 | — | — | US | disclosed |
| US-4017500-A | FUNGICIDES, BACTERICIDES | SCHERING CORPORATION (US) | 1977-04-12 | — | — | US | disclosed |