Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS2 | P35228 | 2/20 | 0.52 |
| ▸ | ESR1 | P03372 | 1/20 | 0.46 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.46 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.43 |
| ▸ | HRH2 | P25021 | 1/20 | 0.40 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.40 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | SCN1A | P35498 | 1/20 | 0.36 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.36 |
| ▸ | NOS3 | P29474 | 1/20 | 0.36 |
| ▸ | NOS1 | P29475 | 1/20 | 0.36 |
| ▸ | IKBKB | O14920 | 1/20 | 0.36 |
| ▸ | GABRP | O00591 | 1/20 | 0.35 |
| ▸ | GABRD | O14764 | 1/20 | 0.35 |
| ▸ | GABRA1 | P14867 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL8980571 | 0.93 | KCNH2 (0.52) | NOS2ESR1ESR2KCNH2HRH2 | |
| SCHEMBL1186862 | 0.90 | NOS2 (0.44) | NOS2ESR1ESR2KCNH2HRH2 | |
| SCHEMBL1187440 | 0.87 | NOS2 (0.46) | NOS2ESR1ESR2KCNH2HRH2 | |
| SCHEMBL9843770 | 0.86 | NOS2 (0.44) | NOS2ESR1ESR2KCNH2HRH2 | |
| SCHEMBL1187782 | 0.85 | NOS2 (0.47) | NOS2ESR1ESR2KCNH2HRH2 | |
| SCHEMBL1187352 | 0.84 | KCNH2 (0.44) | NOS2ESR1ESR2KCNH2HRH2 | |
| SCHEMBL1187612 | 0.82 | KCNH2 (0.47) | NOS2ESR1ESR2KCNH2 | |
| SCHEMBL1187574 | 0.82 | KCNH2 (0.47) | NOS2ESR1ESR2KCNH2 | |
| SCHEMBL1188509 | 0.82 | KCNH2 (0.47) | NOS2ESR1ESR2KCNH2 | |
| SCHEMBL1189648 | 0.82 | KCNH2 (0.47) | NOS2ESR1ESR2KCNH2 |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-108884025-A | Dual-carbodiimide and poly- carbodiimide and preparation method thereof | 陶氏环球技术有限责任公司 | 2018-11-23 | — | — | CN | claimed |
| CN-102643314-A | Preparation methods of R-2-O-benzyl-3-O-p-methoxybenzyl-beta-D-mannose and FDL precursor | CHANGSHU HUAYI CHEMICALS CO LTD | 2012-08-22 | — | — | CN | claimed |
| EP-2459565-B1 | SAXITOXIN DERIVATIVES, METHODS AND COMPOSITIONS FOR STUDYING, IMAGING, AND TREATING PAIN | UNIV LELAND STANFORD JUNIOR (US) | 2018-05-02 | — | — | EP | disclosed |
| CN-102643314-A | Preparation methods of R-2-O-benzyl-3-O-p-methoxybenzyl-beta-D-mannose and FDL precursor | CHANGSHU HUAYI CHEMICALS CO LTD | 2012-08-22 | — | — | CN | disclosed |
| US-20100322858-A1 | Radiohaloimatinibs and Methods of Their Synthesis and Use in PET Imaging of Cancers | BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM | 2010-12-23 | — | — | US | disclosed |
| US-7473446-B2 | Retarder and circular polarizer | FUJIFILM CORPORATION (JP) | 2009-01-06 | — | — | US | disclosed |
| WO-2008024830-A2 | RADIOHALOIMATINIBS AND METHODS OF THEIR SYNTHESIS AND USE IN PET IMAGING OF CANCERS | BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) | 2008-02-28 | — | — | WO | disclosed |