Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM2 | P08172 | 1/20 | 0.38 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.38 |
| ▸ | CASP6 | P55212 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.37 |
| ▸ | POLB | P06746 | 3/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 3/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 2/20 | 0.35 |
| ▸ | MGAM | O43451 | 1/20 | 0.35 |
| ▸ | SI | P14410 | 1/20 | 0.35 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.35 |
| ▸ | RECQL | P46063 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | GPR183 | P32249 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 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 | |
|---|---|---|---|---|
| SCHEMBL3271825 | 0.83 | ALDH1A1 (0.45) | ALDH1A1POLBSMN1; SMN2TSHRLMNA | |
| SCHEMBL12251138 | 0.82 | MGAM (0.36) | CHRM1CASP6ALDH1A1KDM4EPOLB | |
| SCHEMBL6542505 | 0.81 | MAPT (0.47) | ALDH1A1POLBSMN1; SMN2TSHRLMNA | |
| SCHEMBL2538012 | 0.81 | SMN1; SMN2 (0.42) | CHRM2CHRM1CASP6ALDH1A1KDM4E | |
| SCHEMBL2533889 | 0.79 | MGAM (0.36) | ALDH1A1KDM4EPOLBSMN1; SMN2TSHR | |
| SCHEMBL7016567 | 0.78 | MAPT (0.41) | ALDH1A1KDM4ESMN1; SMN2TSHRLMNA | |
| SCHEMBL28263285 | 0.77 | KDM4E (0.54) | ALDH1A1KDM4EGPR183 | |
| SCHEMBL11166353 | 0.77 | RAD52 (0.58) | ALDH1A1KDM4ETSHRLMNAGAA | |
| SCHEMBL4033065 | 0.76 | MAPT (0.41) | ALDH1A1KDM4ESMN1; SMN2TSHRLMNA | |
| SCHEMBL19554714 | 0.76 | MAPT (0.41) | ALDH1A1KDM4ESMN1; SMN2TSHRLMNA |
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 |
|---|---|---|---|---|---|---|---|
| EP-2032582-A1 | PYRIMIDINE DERIVATIVES AS PI3K INHIBITORS | F.HOFFMANN-LA ROCHE AG (CH) | 2009-03-11 | — | — | EP | disclosed |
| WO-2007122410-A1 | PYRIMIDINE DERIVATIVES AS PI3K INHIBITORS | F.HOFFMANN-LA ROCHE AG (CH) | 2007-11-01 | — | — | WO | disclosed |