Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 3/20 | 0.38 |
| ▸ | PNMT | P11086 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.37 |
| ▸ | CYP2A13 | Q16696 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.35 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.35 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.35 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL2126992 | 0.81 | TAAR1 (0.40) | IDO1PNMTHTTKDM4ETAAR1 | |
| SCHEMBL2127284 | 0.79 | SLC6A2 (0.36) | IDO1PNMTHTTKDM4ETAAR1 | |
| SCHEMBL16165985 | 0.78 | CNR2 (0.35) | KDM4E | |
| SCHEMBL16165982 | 0.78 | GAA (0.33) | KDM4EAOC3 | |
| SCHEMBL9353042 | 0.72 | KCNH2 (0.39) | IDO1PNMTHTTKDM4ETAAR1 | |
| SCHEMBL29290780 | 0.71 | IDO1 (0.41) | IDO1PNMTHTTKDM4ETAAR1 | |
| SCHEMBL31142998 | 0.69 | IDO1 (0.38) | IDO1PNMTHTTKDM4ETAAR1 | |
| SCHEMBL6573590 | 0.69 | IDO1 (0.38) | IDO1PNMTHTTKDM4ETAAR1 | |
| SCHEMBL9683385 | 0.69 | ALDH1A1 (0.40) | IDO1PNMTHTTKDM4ETAAR1 | |
| SCHEMBL1282488 | 0.68 | L3MBTL1 (0.48) | NPC1RAB9AKCNH2 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0618918-B1 | PROCESS FOR THE PREPARATION OF ETHER SOLUTIONS OF GRIGNARD COMPOUNDS | ZENECA LTD (GB) | 2000-01-19 | — | — | EP | disclosed |
| EP-0594658-B1 | PROCESS FOR THE PREPARATION OF ARYL AND ARALKYL MAGNESIUM HALIDES | ZENECA LTD (GB) | 1996-11-20 | — | — | EP | disclosed |
| EP-0594658-A1 | PROCESS FOR THE PREPARATION OF ARYL AND ARALKYL MAGNESIUM HALIDES. | ZENECA LTD (GB) | 1994-05-04 | — | — | EP | disclosed |
| US-5242625-A | Preparation of Grignard reagents in high boiling solvent | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1993-09-07 | — | — | US | disclosed |
| US-5209459-A | Alternative ether solvent for preparation of arylmagnesium halide Grignard reagent | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1993-05-11 | — | — | US | disclosed |
| WO-1993002086-A1 | PROCESS FOR THE PREPARATION OF ARYL AND ARALKYL MAGNESIUM HALIDES | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1993-02-04 | — | — | WO | disclosed |