Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.67 |
| ▸ | MPO | P05164 | 2/20 | 0.45 |
| ▸ | GAA | P10253 | 2/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.45 |
| ▸ | HDAC7 | Q8WUI4 | 4/20 | 0.44 |
| ▸ | HDAC8 | Q9BY41 | 4/20 | 0.44 |
| ▸ | HDAC6 | Q9UBN7 | 4/20 | 0.44 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.44 |
| ▸ | HDAC2 | Q92769 | 3/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.44 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.44 |
| ▸ | CA12 | O43570 | 1/20 | 0.44 |
| ▸ | CA1 | P00915 | 1/20 | 0.44 |
| ▸ | IDO1 | P14902 | 1/20 | 0.44 |
| ▸ | CA9 | Q16790 | 1/20 | 0.44 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.44 |
| ▸ | MMP3 | P08254 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL1025413 | 1.00 | CYP1A2 (0.67) | CYP1A2MPOGAAKDM4ESMN1; SMN2 | |
| SCHEMBL7864373 | 0.92 | CYP1A2 (0.56) | CYP1A2MPOGAAKDM4ESMN1; SMN2 | |
| SCHEMBL22122 | 0.82 | CYP1A2 (1.00) | CYP1A2GAAKDM4ESMN1; SMN2HDAC8 | |
| SCHEMBL29417502 | 0.82 | CYP1A2 (1.00) | CYP1A2GAAKDM4ESMN1; SMN2HDAC8 | |
| SCHEMBL1026340 | 0.81 | HSD17B10 (0.60) | CYP1A2MPOGAAKDM4ESMN1; SMN2 | |
| SCHEMBL4959993 | 0.79 | CYP1A2 (0.64) | CYP1A2GAASMN1; SMN2HDAC8HDAC6 | |
| SCHEMBL1538062 | 0.79 | GAA (0.43) | CYP1A2MPOGAAKDM4ESMN1; SMN2 | |
| SCHEMBL12021877 | 0.79 | CYP1A2 (0.64) | CYP1A2GAASMN1; SMN2HDAC8HDAC6 | |
| SCHEMBL823142 | 0.79 | CYP1A2 (0.64) | CYP1A2GAASMN1; SMN2HDAC8HDAC6 | |
| SCHEMBL1538065 | 0.79 | GAA (0.43) | CYP1A2MPOGAAKDM4ESMN1; SMN2 |
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-6316639-B1 | REACTING DICARBOXYLIC ACIDS OR ANHYDRIDES WITH A SALT OF HYDROXYL-AMINE IN SOLUTION SELECTED FROM HYDROXYLAMINE SULFATE, HYDROXYLAMINE NITRATE, HYDROXYLAMINE ACETATE, HYDROXYLAMINE TETRAFLUOROBORATE, HYDROXYLAMINE PHOSPHATE | Consortium für elektrochemische Industrie GmbH (DE) | 2001-11-13 | — | — | US | disclosed |