Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SQOR | Q9Y6N5 | 1/20 | 0.38 |
| ▸ | DCTPP1 | Q9H773 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.33 |
| ▸ | ERN1 | O75460 | 1/20 | 0.33 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.31 |
| ▸ | ADRB1 | P08588 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL8600277 | 0.89 | KDM4E (0.31) | SQORCYP1A2CYP2D6KDM4EMEN1 | |
| SCHEMBL8603884 | 0.88 | CYP2D6 (0.34) | CYP2D6CYP19A1CYP2C9CYP2C19PIK3CD | |
| SCHEMBL8601987 | 0.87 | SQOR (0.40) | SQORDCTPP1CYP1A2CYP2D6CYP19A1 | |
| SCHEMBL8601768 | 0.84 | CYP1A2 (0.32) | SQORCYP1A2CYP2D6CYP19A1CYP2C9 | |
| SCHEMBL8597633 | 0.83 | — | — | |
| SCHEMBL8602484 | 0.83 | SQOR (0.38) | SQORDCTPP1CYP1A2CYP2D6CYP19A1 | |
| SCHEMBL8603951 | 0.81 | SQOR (0.33) | SQORCCNE1CDK2 | |
| SCHEMBL8596032 | 0.79 | SQOR (0.38) | SQORDCTPP1CYP1A2CYP2D6ERN1 | |
| SCHEMBL8601977 | 0.78 | SQOR (0.39) | SQORDCTPP1CYP1A2CYP2D6ERN1 | |
| SCHEMBL8602621 | 0.77 | SQOR (0.31) | SQOR |
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-5779934-A | FLUORINATING AN ALCOHOL DERIVATIVE | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1998-07-14 | — | — | US | disclosed |