Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SQOR | Q9Y6N5 | 1/20 | 0.40 |
| ▸ | DCTPP1 | Q9H773 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | METAP1 | P53582 | 1/20 | 0.34 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.32 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.32 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.32 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.32 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | MGAM | O43451 | 3/20 | 0.30 |
| ▸ | GAA | P10253 | 3/20 | 0.30 |
| ▸ | SI | P14410 | 3/20 | 0.30 |
| ▸ | MGAM2 | Q2M2H8 | 3/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL8597508 | 0.90 | SQOR (0.32) | SQORDCTPP1CYP2D6CHRNB2CHRNB4 | |
| SCHEMBL8601925 | 0.89 | CYP2D6 (0.38) | SQORDCTPP1CYP2D6CYP19A1CYP2C9 | |
| SCHEMBL8603951 | 0.87 | SQOR (0.33) | SQOR | |
| SCHEMBL8601985 | 0.87 | SQOR (0.38) | SQORDCTPP1CYP2D6CYP1A2CYP19A1 | |
| SCHEMBL8601768 | 0.81 | CYP1A2 (0.32) | SQORCYP2D6CYP1A2CYP19A1CYP2C9 | |
| SCHEMBL8596620 | 0.81 | DCTPP1 (0.41) | SQORDCTPP1CYP2D6CYP1A2CYP19A1 | |
| SCHEMBL8604387 | 0.79 | SQOR (0.40) | SQORDCTPP1CYP2D6CYP1A2CYP19A1 | |
| SCHEMBL8602484 | 0.79 | SQOR (0.38) | SQORDCTPP1CYP2D6CYP1A2CYP19A1 | |
| SCHEMBL8601719 | 0.77 | DCTPP1 (0.33) | SQORDCTPP1MGAMGAASI | |
| SCHEMBL8598141 | 0.77 | — | — |
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 |