Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRIN1 | Q05586 | 1/20 | 0.39 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.35 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 3/20 | 0.33 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.33 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 2/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | GLA | P06280 | 1/20 | 0.31 |
| ▸ | PIM1 | P11309 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL10120651 | 0.82 | KDM4E (0.40) | KDM4EPOLBSMN1; SMN2ALDH1A1CYP2A6 | |
| SCHEMBL1056459 | 0.79 | KDM4E (0.39) | KDM4EPOLBSMN1; SMN2ALDH1A1CYP2A6 | |
| SCHEMBL1061978 | 0.79 | ADORA2A (0.38) | KDM4EPOLBSMN1; SMN2ALDH1A1CYP2A6 | |
| SCHEMBL10105623 | 0.77 | KDM4E (0.34) | KDM4EPOLBSMN1; SMN2ALDH1A1CYP2A6 | |
| SCHEMBL1823085 | 0.74 | GABRP (0.46) | KDM4EPOLBSMN1; SMN2ALDH1A1MAPT | |
| SCHEMBL1822851 | 0.73 | KDM4E (0.40) | KDM4EPOLBSMN1; SMN2ALDH1A1CYP1A2 | |
| SCHEMBL354152 | 0.73 | NNMT (0.45) | KDM4EPOLBSMN1; SMN2CYP1A2CYP2C9 | |
| Hydrochloric Acid SCHEMBL1822852 | 0.73 | GABRP (0.45) | KDM4EPOLBSMN1; SMN2ALDH1A1MAPT | |
| SCHEMBL31033057 | 0.72 | KDM4E (0.46) | GRIN1GRIN2BKDM4EALDH1A1ADORA2A | |
| SCHEMBL10120648 | 0.72 | KDM4E (0.39) | KDM4EPOLBSMN1; SMN2ALDH1A1CYP2A6 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2010048149-A2 | HETEROCYCLIC MODULATORS OF GPR119 FOR TREATMENT OF DISEASE | KALYPSYS, INC. (US) | 2010-04-29 | — | — | WO | disclosed |
| WO-2010048149-A2 | HETEROCYCLIC MODULATORS OF GPR119 FOR TREATMENT OF DISEASE | KALYPSYS, INC. (US) | 2010-04-29 | — | — | WO | disclosed |