Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 3/20 | 0.38 |
| ▸ | GABRP | O00591 | 2/20 | 0.38 |
| ▸ | GABRD | O14764 | 2/20 | 0.38 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.38 |
| ▸ | GABRB1 | P18505 | 2/20 | 0.38 |
| ▸ | GABRG2 | P18507 | 2/20 | 0.38 |
| ▸ | GABRB3 | P28472 | 2/20 | 0.38 |
| ▸ | GABRA5 | P31644 | 2/20 | 0.38 |
| ▸ | GABRA3 | P34903 | 2/20 | 0.38 |
| ▸ | GABRA2 | P47869 | 2/20 | 0.38 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.38 |
| ▸ | GABRA4 | P48169 | 2/20 | 0.38 |
| ▸ | GABRE | P78334 | 2/20 | 0.38 |
| ▸ | GABRA6 | Q16445 | 2/20 | 0.38 |
| ▸ | GABRG1 | Q8N1C3 | 2/20 | 0.38 |
| ▸ | GABRG3 | Q99928 | 2/20 | 0.38 |
| ▸ | GABRQ | Q9UN88 | 2/20 | 0.38 |
| ▸ | TET2 | Q6N021 | 3/20 | 0.31 |
| ▸ | KDM4A | O75164 | 2/20 | 0.31 |
| ▸ | KDM4C | Q9H3R0 | 2/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL4541454 | 0.72 | PTGS2 (0.34) | ALDH1A1TSHRSMN1; SMN2MAPK1KDM4E | |
| SCHEMBL21160908 | 0.71 | — | — | |
| SCHEMBL4235241 | 0.68 | AKR1C3 (0.35) | CYP2C19SMN1; SMN2 | |
| SCHEMBL242853 | 0.64 | RIPK1 (0.52) | CYP1A2GABRPGABRDGABRA1GABRB1 | |
| SCHEMBL8673121 | 0.64 | RIPK1 (0.52) | CYP1A2GABRPGABRDGABRA1GABRB1 | |
| SCHEMBL10042378 | 0.64 | RIPK1 (0.52) | CYP1A2GABRPGABRDGABRA1GABRB1 | |
| SCHEMBL20534655 | 0.64 | ALDH1A1 (0.49) | CYP1A2GABRPGABRDGABRA1GABRB1 | |
| SCHEMBL27498071 | 0.64 | BCHE (0.43) | CYP1A2GABRPGABRDGABRA1GABRB1 | |
| SCHEMBL27497417 | 0.63 | TBXAS1 (0.58) | CYP2C19SMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL5743278 | 0.63 | RIPK1 (0.50) | CYP1A2CPA3ALDH1A1CYP2D6TSHR |
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-1962832-A2 | COMBINATIONS OF A QUALENE SYNTHASE INHIBITOR AND A HMG-COA REDUCTASE INHIBITOR FOR TREATING HYPERLIPIDEMIA | Takeda Pharmaceutical Company Limited (JP) | 2008-09-03 | — | — | EP | disclosed |
| WO-2006129859-A2 | COMBINATIONS OF A SQUALENE SYNTHASE INHIBITOR AND A HMG-COA REDUCTASE INHIBITOR FOR TREATING HYPERLIPIDEMIA | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2006-12-07 | — | — | WO | disclosed |