Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 8/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.44 |
| ▸ | TSHR | P16473 | 2/20 | 0.44 |
| ▸ | HPGD | P15428 | 4/20 | 0.43 |
| ▸ | GLA | P06280 | 4/20 | 0.43 |
| ▸ | GAA | P10253 | 4/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.43 |
| ▸ | HTT | P42858 | 2/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.43 |
| ▸ | ABCC4 | O15439 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.43 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.43 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.43 |
| ▸ | DRD1 | P21728 | 1/20 | 0.43 |
| ▸ | ACHE | P22303 | 1/20 | 0.43 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.43 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL4848936 | 0.84 | PIK3CA (0.47) | ALDH1A1HSD17B10TSHRHPGDMAPK1 | |
| SCHEMBL4785891 | 0.84 | PIK3CA (0.46) | KDM4EALDH1A1HSD17B10HPGDLMNA | |
| SCHEMBL4786376 | 0.84 | KDM4E (0.45) | KDM4EALDH1A1HSD17B10TSHRHPGD | |
| SCHEMBL4782724 | 0.83 | PIK3CA (0.57) | PIK3CA | |
| SCHEMBL4784742 | 0.82 | PIK3CA (0.42) | ALDH1A1HSD17B10GAAMAPK1LMNA | |
| SCHEMBL4783923 | 0.82 | HRH4 (0.43) | SMN1; SMN2PIK3CA | |
| SCHEMBL4782297 | 0.82 | PIK3CA (0.43) | PIK3CA | |
| SCHEMBL4782541 | 0.81 | DGAT2 (0.40) | ALDH1A1HSD17B10TSHRMAPK1TP53 | |
| SCHEMBL4785905 | 0.81 | ESR1 (0.44) | HSD17B10HPGDPIK3CA | |
| SCHEMBL4782788 | 0.81 | PIK3CA (0.42) | ALDH1A1HSD17B10TSHRHPGDMAPK1 |
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-2008072850-A1 | TRIAZINE DERIVATIVES HAVING INHIBITORY ACTIVITY AGAINST ACETYL-COA CARBOXYLASE | AMOREPACIFIC CORPORATION (KR) | 2008-06-19 | — | — | WO | disclosed |