Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CD | O00329 | 7/20 | 0.39 |
| ▸ | MTOR | P42345 | 5/20 | 0.39 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.39 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.39 |
| ▸ | PIK3CA | P42336 | 7/20 | 0.39 |
| ▸ | PIK3CG | P48736 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | ATR | Q13535 | 2/20 | 0.36 |
| ▸ | PIK3R1 | P27986 | 1/20 | 0.35 |
| ▸ | CA12 | O43570 | 1/20 | 0.35 |
| ▸ | CA1 | P00915 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | CA9 | Q16790 | 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 | |
|---|---|---|---|---|
| SCHEMBL8084833 | 0.91 | CA12 (0.43) | MAPTHTTCA12CA1CA2 | |
| SCHEMBL8091191 | 0.91 | PIK3CA (0.40) | PIK3CDMTORPIK3CAPIK3CGATR | |
| SCHEMBL8090316 | 0.90 | KDR (0.37) | PIK3CDMTORPIK3CAPIK3CGKDM4E | |
| SCHEMBL8090948 | 0.89 | CA12 (0.41) | MTORPIK3CAKDM4EMAPTHTT | |
| SCHEMBL8084016 | 0.89 | CA12 (0.41) | MTORPIK3CAKDM4EMAPTHTT | |
| SCHEMBL8084603 | 0.86 | PIK3CA (0.46) | PIK3CDMTORHDAC3HDAC1HDAC2 | |
| SCHEMBL8090246 | 0.86 | PIK3CA (0.42) | PIK3CDMTORPIK3CAPIK3CGKDM4E | |
| SCHEMBL8091293 | 0.85 | MAPT (0.42) | MTORPIK3CAPIK3CGKDM4EMAPT | |
| SCHEMBL8099405 | 0.85 | EPHX1 (0.42) | MTORPIK3CAKDM4EMAPTHTT | |
| SCHEMBL8098812 | 0.84 | NPC1 (0.43) | MAPTHTTCA12CA1CA2 |
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-2009007748-A2 | TRISUBSTITUTED PYRIMIDINE DERIVATIVES FOR THE TREATMENT OF PROLIFERATIVE DISEASES | ASTRAZENECA AB (SE) | 2009-01-15 | — | — | WO | disclosed |