Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCNC | P24863 | 1/20 | 0.41 |
| ▸ | CDK8 | P49336 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 4/20 | 0.40 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.39 |
| ▸ | ALPL | P05186 | 1/20 | 0.39 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.39 |
| ▸ | IKBKB | O14920 | 1/20 | 0.37 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 2/20 | 0.36 |
| ▸ | GPBAR1 | Q8TDU6 | 1/20 | 0.35 |
| ▸ | KAT6A | Q92794 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.35 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.35 |
| ▸ | PRKAB2 | O43741 | 1/20 | 0.35 |
| ▸ | PRKAG1 | P54619 | 1/20 | 0.35 |
| ▸ | PRKAA2 | P54646 | 1/20 | 0.35 |
| ▸ | PRKAA1 | Q13131 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL16112230 | 0.84 | MAPK1 (0.43) | CCNCCDK8ALDH1A1MAPK1NOTUM | |
| SCHEMBL1990297 | 0.70 | GABRP (0.52) | CCNCCDK8ALDH1A1MAPK1ALPL | |
| SCHEMBL16112306 | 0.69 | DOT1L (0.41) | CCNCCDK8ALDH1A1MAPK1NOTUM | |
| SCHEMBL10901104 | 0.69 | DYRK1A (0.58) | ALDH1A1ALPLCYP2A6IKBKBKDM4E | |
| SCHEMBL16111746 | 0.69 | GAA (0.46) | CCNCCDK8ALDH1A1ALPLMEN1 | |
| SCHEMBL5924860 | 0.68 | CYP2A6 (0.54) | ALDH1A1ALPLCYP2A6IKBKBKAT6A | |
| SCHEMBL15124553 | 0.68 | CYP2A6 (0.54) | ALDH1A1ALPLCYP2A6IKBKBKAT6A | |
| SCHEMBL11265372 | 0.66 | POLB (0.46) | ALDH1A1POLBGPBAR1KDM4EHPGD | |
| SCHEMBL5820946 | 0.66 | TSHR (0.44) | KDM4EHPGD | |
| SCHEMBL16117898 | 0.66 | JAK3 (0.43) | ALDH1A1MAPK1MEN1KMT2A |
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-2014159214-A1 | HISTONE DEACETYLASE INHIBITORS AND COMPOSITIONS AND METHODS OF USE THEREOF | CHDI FOUNDATION, INC. (US) | 2014-10-02 | — | — | WO | disclosed |