Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DGAT1 | O75907 | 1/20 | 0.47 |
| ▸ | CES2 | O00748 | 7/20 | 0.45 |
| ▸ | CES1 | P23141 | 7/20 | 0.45 |
| ▸ | MAP2K2 | P36507 | 1/20 | 0.41 |
| ▸ | MAP2K1 | Q02750 | 1/20 | 0.41 |
| ▸ | HTR1A | P08908 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | CASP1 | P29466 | 1/20 | 0.35 |
| ▸ | BCHE | P06276 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | ATM | Q13315 | 1/20 | 0.34 |
| ▸ | PARP10 | Q53GL7 | 2/20 | 0.34 |
| ▸ | PARP15 | Q460N3 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL1003016 | 0.82 | CES2 (0.67) | DGAT1CES2CES1MAP2K2MAP2K1 | |
| SCHEMBL811064 | 0.81 | DGAT1 (0.52) | DGAT1CES2CES1MAP2K2MAP2K1 | |
| SCHEMBL201107 | 0.78 | DGAT1 (0.47) | DGAT1CES2CES1MAP2K2MAP2K1 | |
| SCHEMBL3026191 | 0.78 | DGAT1 (0.47) | DGAT1CES2CES1MAP2K2MAP2K1 | |
| SCHEMBL5802725 | 0.77 | DGAT1 (0.46) | DGAT1CES2CES1MAP2K2MAP2K1 | |
| SCHEMBL30827695 | 0.77 | DGAT1 (0.55) | DGAT1CES2CES1MAP2K2MAP2K1 | |
| SCHEMBL30258821 | 0.74 | CES2 (0.50) | DGAT1CES2CES1MAP2K2MAP2K1 | |
| SCHEMBL2646259 | 0.74 | CES2 (0.48) | DGAT1CES2CES1ALDH1A1MAPT | |
| SCHEMBL4355806 | 0.74 | CES2 (0.50) | DGAT1CES2CES1MAP2K2MAP2K1 | |
| SCHEMBL1204044 | 0.74 | CES2 (0.50) | DGAT1CES2CES1MAP2K2MAP2K1 |
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 |
|---|---|---|---|---|---|---|---|
| US-7585869-B2 | Substituted heterocylces for the treatment of abnormal cell growth | PFIZER, INC. (US) | 2009-09-08 | — | — | US | claimed |