Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 3/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.36 |
| ▸ | APBA1 | Q02410 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | MEN1 | O00255 | 3/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | SNCA | P37840 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.31 |
| ▸ | PTP4A3 | O75365 | 1/20 | 0.31 |
| ▸ | PTP4A1 | Q93096 | 1/20 | 0.31 |
| ▸ | PKM | P14618 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
| ▸ | APP | P05067 | 1/20 | 0.30 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | GLA | P06280 | 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 | |
|---|---|---|---|---|
| SCHEMBL10497073 | 0.90 | CYP3A4 (0.35) | CYP3A4MAPTTSHRCACNA1BAPBA1 | |
| SCHEMBL177943 | 0.83 | CYP3A4 (0.48) | CYP3A4MAPTTSHRCACNA1BAPBA1 | |
| SCHEMBL27702 | 0.83 | — | — | |
| SCHEMBL27833417 | 0.83 | KMT2A (0.45) | KMT2AALDH1A1 | |
| Urea SCHEMBL11500350 | 0.82 | MAPT (0.38) | CYP3A4MAPTTSHRCACNA1BAPBA1 | |
| Ammonia Solution, Strong SCHEMBL15742962 | 0.81 | — | — | |
| SCHEMBL7512684 | 0.81 | CYP3A4 (0.46) | CYP3A4MAPTTSHRCACNA1BAPBA1 | |
| Allyl Alcohol SCHEMBL28109758 | 0.79 | TSHR (0.45) | TSHRKMT2AALDH1A1 | |
| Trimethylammonium SCHEMBL1905840 | 0.75 | KMT2A (0.43) | KMT2AALDH1A1MEN1 | |
| SCHEMBL10966895 | 0.74 | CYP3A4 (0.45) | CYP3A4MAPTTSHRCACNA1BAPBA1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0310191-B1 | Process and reaction vessel for production of alkyl nitrite | UNION CARBIDE CORP (US) | 1994-02-16 | — | — | EP | disclosed |
| US-4908466-A | Process and reaction vessel for production of alkyl nitrite | UNION CARBIDE CHEMICALS AND PLASTICS COMPANY INC. (US) | 1990-03-13 | — | — | US | disclosed |
| US-4879401-A | Process for removal of impurities in alkyl nitrite formation | UNION CARBIDE CHEMICALS AND PLASTICS COMPANY INC. (US) | 1989-11-07 | — | — | US | disclosed |
| EP-0310191-A2 | Process and reaction vessel for production of alkyl nitrite | UNION CARBIDE CORPORATION (US) | 1989-04-05 | — | — | EP | disclosed |