Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.36 |
| ▸ | APBA1 | Q02410 | 1/20 | 0.36 |
| ▸ | APP | P05067 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | SOAT1 | P35610 | 1/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.31 |
| ▸ | CA1 | P00915 | 1/20 | 0.31 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
| ▸ | SNCA | P37840 | 1/20 | 0.30 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL47912 | 0.84 | CYP3A4 (0.45) | CYP3A4PKMSMN1; SMN2TSHRMAPT | |
| SCHEMBL692505 | 0.82 | CYP3A4 (0.41) | CYP3A4PKMSMN1; SMN2TSHRMAPT | |
| SCHEMBL9110969 | 0.81 | CYP3A4 (0.43) | CYP3A4PKMSMN1; SMN2TSHRMAPT | |
| SCHEMBL27520615 | 0.81 | CYP3A4 (0.37) | CYP3A4PKMSMN1; SMN2TSHRMAPT | |
| Bicarbonate SCHEMBL9658182 | 0.79 | CYP3A4 (0.45) | CYP3A4PKMSMN1; SMN2TSHRMAPT | |
| Bicarbonate SCHEMBL10805236 | 0.79 | CYP3A4 (0.45) | CYP3A4PKMSMN1; SMN2TSHRMAPT | |
| Bicarbonate SCHEMBL27897261 | 0.79 | CYP3A4 (0.45) | CYP3A4PKMSMN1; SMN2TSHRMAPT | |
| SCHEMBL9928 | 0.78 | CYP3A4 (0.48) | CYP3A4PKMSMN1; SMN2TSHRMAPT | |
| Ethylene Glycol SCHEMBL1923456 | 0.77 | CYP3A4 (0.41) | CYP3A4PKMSMN1; SMN2TSHRMAPT | |
| Ethylene Glycol SCHEMBL11184725 | 0.77 | CYP3A4 (0.37) | CYP3A4PKMSMN1; SMN2TSHRMAPT |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8673885-B1 | Compounds for the protection of sulfur containing linkers in nucleic acid synthesis | DUFF ROBERT (US) | 2014-03-18 | — | — | US | disclosed |