Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC6 | Q9UBN7 | 9/20 | 0.61 |
| ▸ | HDAC1 | Q13547 | 5/20 | 0.61 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.58 |
| ▸ | EGLN2 | Q96KS0 | 1/20 | 0.58 |
| ▸ | HDAC8 | Q9BY41 | 9/20 | 0.56 |
| ▸ | HDAC2 | Q92769 | 5/20 | 0.52 |
| ▸ | HDAC3 | O15379 | 3/20 | 0.52 |
| ▸ | HDAC7 | Q8WUI4 | 2/20 | 0.52 |
| ▸ | CA12 | O43570 | 1/20 | 0.52 |
| ▸ | CA1 | P00915 | 1/20 | 0.52 |
| ▸ | IDO1 | P14902 | 1/20 | 0.52 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.52 |
| ▸ | CA9 | Q16790 | 1/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.52 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.52 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.45 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.45 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.45 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.45 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL190230 | 0.83 | HDAC6 (0.59) | HDAC6HDAC1KDM4EHDAC8HDAC2 | |
| SCHEMBL29956030 | 0.83 | ALDH1A1 (0.59) | HDAC6HDAC1KDM4ECA1ENPP2 | |
| SCHEMBL1445203 | 0.83 | ALDH1A1 (0.59) | HDAC6HDAC1KDM4ECA1ENPP2 | |
| Hydrochloric Acid SCHEMBL4551090 | 0.81 | ALDH1A1 (0.58) | HDAC6HDAC1KDM4ECA1ENPP2 | |
| SCHEMBL11791484 | 0.81 | HDAC8 (0.79) | HDAC6HDAC1KDM4EEGLN2HDAC8 | |
| SCHEMBL3756621 | 0.79 | ENPP2 (0.47) | KDM4EENPP2 | |
| SCHEMBL1933481 | 0.79 | HDAC1 (0.63) | HDAC6HDAC1HDAC8HDAC2 | |
| SCHEMBL520859 | 0.79 | LMNA (0.49) | — | |
| SCHEMBL177725 | 0.79 | NPSR1 (0.56) | KDM4EHSD17B10ENPP2 | |
| SCHEMBL3031782 | 0.79 | SMN1; SMN2 (0.50) | HSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1959951-B1 | HETEROARYL SUBSTITUTED PIPERIDINE DERIVATIVES AS L-CPT1 INHIBITORS | HOFFMANN LA ROCHE (CH) | 2009-12-23 | — | — | EP | disclosed |