Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM5 | P41594 | 6/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | PDE1B | Q01064 | 1/20 | 0.40 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.39 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.39 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.39 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.39 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.39 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.39 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.39 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.39 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.39 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL156706 | 0.85 | GRM5 (0.64) | GRM5 | |
| SCHEMBL159565 | 0.76 | GRM5 (0.69) | GRM5 | |
| SCHEMBL1445857 | 0.74 | GAA (0.57) | GAAPOLBALDH1A1CYP1A2CYP2C19 | |
| SCHEMBL8540645 | 0.71 | GAA (0.55) | GAAPOLBALDH1A1CYP1A2CYP2C19 | |
| SCHEMBL31667380 | 0.71 | GAA (0.43) | GAAPOLBALDH1A1CYP1A2CYP2C19 | |
| SCHEMBL4509396 | 0.71 | ACACB (0.64) | GAAALDH1A1CYP1A2CYP2C19SMN1; SMN2 | |
| SCHEMBL10007682 | 0.70 | GAA (0.48) | GAAPOLBALDH1A1CYP1A2CYP2C19 | |
| SCHEMBL29135192 | 0.68 | HDAC1 (0.51) | GAAPOLBALDH1A1CYP1A2CYP2C19 | |
| SCHEMBL29135191 | 0.68 | HDAC1 (0.51) | GAAPOLBALDH1A1CYP1A2CYP2C19 | |
| SCHEMBL3459387 | 0.68 | L3MBTL1 (0.64) | GAAALDH1A1SMN1; SMN2HDAC1HDAC6 |
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-2011073339-A1 | BICYCLIC THIAZOLES AS ALLOSTERIC MODULATORS OF MGLUR5 RECEPTORS | JANSSEN PHARMACEUTICA NV (BE) | 2011-06-23 | — | — | WO | disclosed |