Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NFE2L2 | Q16236 | 5/20 | 0.36 |
| ▸ | ACHE | P22303 | 4/20 | 0.35 |
| ▸ | CYP2A6 | P11509 | 3/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 5/20 | 0.31 |
| ▸ | TP53 | P04637 | 2/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | THRB | P10828 | 1/20 | 0.31 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.30 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.30 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL3610893 | 0.82 | NFE2L2 (0.36) | NFE2L2ACHECYP2A6CYP1A2TDP1 | |
| SCHEMBL362051 | 0.76 | ALDH1A1 (0.42) | NFE2L2CYP2A6CYP1A2TDP1SMN1; SMN2 | |
| SCHEMBL29766167 | 0.76 | ALDH1A1 (0.42) | NFE2L2CYP2A6CYP1A2TDP1SMN1; SMN2 | |
| SCHEMBL1021714 | 0.76 | TDP1 (0.42) | ACHECYP2A6CYP1A2TDP1TP53 | |
| SCHEMBL9510477 | 0.72 | CYP1A2 (0.42) | CYP2A6CYP1A2ALDH1A1 | |
| SCHEMBL636709 | 0.71 | TDP1 (0.42) | ACHECYP2A6CYP1A2TDP1TP53 | |
| SCHEMBL30645502 | 0.71 | TDP1 (0.42) | ACHECYP2A6CYP1A2TDP1TP53 | |
| SCHEMBL26118583 | 0.70 | ACHE (0.56) | ACHECYP1A2TDP1CYP3A4SMN1; SMN2 | |
| SCHEMBL130515 | 0.69 | — | — | |
| SCHEMBL29441288 | 0.69 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-6683218-B1 | REACTING AN ARYL FLUORIDE WITH HALOGENATED HYDROCARBON AND MAGNESIUM; METALLIZATION, BORATING; DISTILLING OUT DIETHYL ETHER OR TETRAHYDROFURAN SOLVENT | NIPPON SHOKUBAI CO., LTD. (JP) | 2004-01-27 | — | — | US | disclosed |
| EP-0825195-B1 | PRODUCING PROCESS OF FLUOROARYL MAGNESIUM DERIVATIVE AND PRODUCING PROCESS OF (FLUOROARYL)BORANE COMPOUND | NIPPON CATALYTIC CHEM IND (JP) | 2003-11-12 | — | — | EP | disclosed |
| US-6057480-A | Process for preparing fluoroaryl magnesium derivative and process for preparing (fluoroaryl) borane compound | NIPPON SHOKUBAI CO., LTD. (JP) | 2000-05-02 | — | — | US | disclosed |
| EP-0838466-A2 | Producing process of (fluoroaryl) borane compound and producing process of tetrakis (fluoroaryl) borate derivative | NIPPON SHOKUBAI CO., LTD. (JP) | 1998-04-29 | — | — | EP | disclosed |
| EP-0825195-A1 | PROCESS FOR THE PREPARATION OF FLUORINATED ARYLMAGNESIUM DERIVATIVES AND PROCESS FOR THE PREPARATION OF (FLUORINATED ARYL)BORON COMPOUNDS | NIPPON SHOKUBAI CO., LTD. (JP) | 1998-02-25 | — | — | EP | disclosed |