Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKT1 | P31749 | 4/20 | 0.40 |
| ▸ | AKT2 | P31751 | 4/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.38 |
| ▸ | HPGD | P15428 | 4/20 | 0.38 |
| ▸ | RAB9A | P51151 | 4/20 | 0.38 |
| ▸ | GLA | P06280 | 3/20 | 0.38 |
| ▸ | GAA | P10253 | 2/20 | 0.38 |
| ▸ | CCNE2 | O96020 | 1/20 | 0.38 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.38 |
| ▸ | CDK2 | P24941 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | GRM5 | P41594 | 2/20 | 0.36 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 3/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | PDE5A | O76074 | 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 | |
|---|---|---|---|---|
| SCHEMBL15116245 | 0.82 | FLT1 (0.39) | KDM4EALDH1A1HPGDRAB9AGLA | |
| SCHEMBL362977 | 0.80 | ALDH1A1 (0.51) | AKT1AKT2KDM4EALDH1A1HPGD | |
| SCHEMBL3706575 | 0.78 | AKT1 (0.43) | AKT1AKT2KDM4EALDH1A1HPGD | |
| SCHEMBL3703538 | 0.73 | AKT1 (0.44) | AKT1AKT2KDM4EALDH1A1HPGD | |
| SCHEMBL3707772 | 0.72 | KDM4E (0.43) | KDM4EALDH1A1RAB9AGLAGAA | |
| SCHEMBL15688194 | 0.67 | ALDH1A1 (0.39) | KDM4EALDH1A1HPGDRAB9AGLA | |
| SCHEMBL6217346 | 0.65 | ALDH1A1 (0.40) | KDM4EALDH1A1HPGDRAB9AGLA | |
| SCHEMBL8217066 | 0.65 | ALDH1A1 (0.39) | KDM4EALDH1A1ADORA2ANPC1 | |
| SCHEMBL23587109 | 0.65 | GRM5 (0.53) | CCNE2CCNE1CDK2GRM5 | |
| SCHEMBL4304728 | 0.64 | ALDH1A1 (0.46) | KDM4EALDH1A1HPGDRAB9AGLA |
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-2396330-A1 | FUSED PYRIMIDINES | Bayer Pharma Aktiengesellschaft (DE) | 2011-12-21 | — | — | EP | disclosed |
| WO-2010091808-A1 | FUSED PYRIMIDINES | BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) | 2010-08-19 | — | — | WO | disclosed |