Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 1/20 | 0.38 |
| ▸ | VNN1 | O95497 | 1/20 | 0.37 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.36 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.36 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.36 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.36 |
| ▸ | SCD | O00767 | 2/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.35 |
| ▸ | PRKACA | P17612 | 2/20 | 0.35 |
| ▸ | GSK3B | P49841 | 2/20 | 0.35 |
| ▸ | CLK4 | Q9HAZ1 | 2/20 | 0.35 |
| ▸ | MKNK2 | Q9HBH9 | 2/20 | 0.35 |
| ▸ | CDC7 | O00311 | 1/20 | 0.35 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.35 |
| ▸ | PIM1 | P11309 | 1/20 | 0.35 |
| ▸ | CDK2 | P24941 | 1/20 | 0.35 |
| ▸ | HIPK2 | Q9H2X6 | 1/20 | 0.35 |
| ▸ | IRAK4 | Q9NWZ3 | 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 | |
|---|---|---|---|---|
| SCHEMBL1697136 | 0.76 | ADORA2B (0.47) | CDK2ADORA3ADORA2AADORA2BRPS6KA3 | |
| SCHEMBL1721018 | 0.75 | EGFR (0.38) | EGFRVNN1HDAC3HDAC1HDAC2 | |
| SCHEMBL1720325 | 0.72 | ADORA3 (0.42) | EGFRSCDCDK2ADORA3ADORA2A | |
| SCHEMBL10224410 | 0.67 | KDM1A (0.58) | EGFRVNN1HDAC3HDAC1HDAC2 | |
| SCHEMBL1290422 | 0.67 | KDM1A (0.58) | EGFRVNN1HDAC3HDAC1HDAC2 | |
| SCHEMBL1290421 | 0.67 | KDM1A (0.58) | EGFRVNN1HDAC3HDAC1HDAC2 | |
| SCHEMBL20731028 | 0.67 | PTGS1 (0.55) | EGFRVNN1HDAC3HDAC1HDAC2 | |
| SCHEMBL2687202 | 0.67 | ADORA2B (0.51) | CDK2ADORA3ADORA2AADORA2BRPS6KA3 | |
| Hydrochloric Acid SCHEMBL15346052 | 0.66 | KDM1A (0.57) | EGFRVNN1HDAC3HDAC1HDAC2 | |
| Hydrochloric Acid SCHEMBL15346054 | 0.66 | KDM1A (0.57) | EGFRVNN1HDAC3HDAC1HDAC2 |
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-2405917-A2 | SUBSTITUTED FUSED PYRIMIDINE COMPOUNDS | Advinus Therapeutics Private Limited (IN) | 2012-01-18 | — | — | EP | disclosed |
| WO-2010103547-A2 | SUBSTITUTED FUSED PYRIMIDINE COMPOUNDS | ADVINUS THERAPEUTICS PRIVATE LIMITED (IN) | 2010-09-16 | — | — | WO | disclosed |