Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 5/20 | 0.64 |
| ▸ | HDAC2 | Q92769 | 5/20 | 0.64 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.51 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.46 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL19407338 | 0.84 | NPSR1 (0.64) | HDAC1HDAC2CYP1A2HDAC8KDM4E | |
| SCHEMBL29858336 | 0.84 | NPSR1 (0.64) | HDAC1HDAC2CYP1A2HDAC8KDM4E | |
| SCHEMBL15578063 | 0.82 | HDAC1 (0.61) | HDAC1HDAC2CYP1A2HDAC8ADORA2A | |
| SCHEMBL28205113 | 0.81 | HDAC1 (0.57) | HDAC1HDAC2CYP1A2HDAC8ADORA2A | |
| SCHEMBL20353961 | 0.81 | HDAC1 (0.59) | HDAC1HDAC2CYP1A2HDAC8RAB9A | |
| SCHEMBL31536348 | 0.80 | HDAC1 (0.56) | HDAC1HDAC2CYP1A2HDAC8ADORA2A | |
| SCHEMBL20353962 | 0.80 | CYP1A2 (0.61) | HDAC1HDAC2CYP1A2HDAC8RAB9A | |
| SCHEMBL12561165 | 0.77 | HDAC1 (0.52) | HDAC1HDAC2CYP1A2HDAC8RAB9A | |
| SCHEMBL10113597 | 0.76 | HDAC1 (0.64) | HDAC1HDAC2LMNAHDAC6KMT2A | |
| SCHEMBL10113871 | 0.76 | HDAC1 (0.63) | HDAC1HDAC2CYP1A2LMNAHDAC6 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011006935-A2 | TETRAZOLE DERIVATIVES | MERCK SERONO S.A. (CH) | 2011-01-20 | — | — | WO | disclosed |