Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB2 | P07550 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.44 |
| ▸ | MMP2 | P08253 | 1/20 | 0.42 |
| ▸ | MMP8 | P22894 | 1/20 | 0.42 |
| ▸ | MMP14 | P50281 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.42 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.42 |
| ▸ | MMP1 | P03956 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.37 |
| ▸ | LMNA | P02545 | 3/20 | 0.36 |
| ▸ | HTT | P42858 | 2/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 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 | |
|---|---|---|---|---|
| SCHEMBL7238679 | 0.77 | MAOA (0.48) | HSD17B10SLC6A3SLC6A2HPGDCYP2D6 | |
| SCHEMBL216701 | 0.77 | HSD17B10 (0.50) | ADRB2HSD17B10CYP2C9CYP2C19MMP2 | |
| SCHEMBL7246793 | 0.75 | LMNA (0.41) | TSHRHPGDSLC6A4LMNATP53 | |
| SCHEMBL315823 | 0.75 | HSD17B10 (0.48) | ADRB2HSD17B10CYP2C9CYP2C19MMP2 | |
| SCHEMBL7242681 | 0.74 | MEN1 (0.42) | CYP2C19TSHRCYP3A4CYP2D6LMNA | |
| SCHEMBL13113805 | 0.74 | ADRB2 (0.52) | ADRB2HSD17B10CYP2C9CYP2C19MMP2 | |
| SCHEMBL7123357 | 0.73 | HSD17B10 (0.52) | ADRB2HSD17B10CYP2C9CYP2C19MMP2 | |
| SCHEMBL15241839 | 0.73 | CYP2C9 (0.47) | ADRB2HSD17B10CYP2C9CYP2C19MMP2 | |
| SCHEMBL11445163 | 0.72 | TSHR (0.45) | ADRB2HSD17B10CYP2C9CYP2C19MMP2 | |
| SCHEMBL11162285 | 0.72 | HSD17B10 (0.42) | ADRB2HSD17B10CYP2C9CYP2C19MMP2 |
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-6639109-B1 | Reacting amino alcohol with sulfuric acid then reacting resulting amino sulfate with a mercaptan; simple, safe, rapid | NIHON NOHYAKU CO., LTD. (JP) | 2003-10-28 | — | — | US | disclosed |
| EP-1216988-A1 | THIOALKYLAMINE DERIVATIVES AND PROCESS FOR THE PREPARATION THEREOF | Nihon Nohyaku Co., Ltd. (JP) | 2002-06-26 | — | — | EP | disclosed |