Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 3/20 | 0.38 |
| ▸ | SIGMAR1 | Q99720 | 6/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | CYP4Z1 | Q86W10 | 1/20 | 0.36 |
| ▸ | CYP4F11 | Q9HBI6 | 1/20 | 0.36 |
| ▸ | CYP4F12 | Q9HCS2 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 3/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | USP2 | O75604 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | GAA | P10253 | 2/20 | 0.34 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.34 |
| ▸ | HTT | P42858 | 2/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.34 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.32 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL11145882 | 1.00 | CYP2C9 (0.38) | CYP2C9SIGMAR1CYP3A4CYP2D6CYP1A2 | |
| SCHEMBL11783176 | 0.81 | CYP2C9 (0.39) | CYP2C9SIGMAR1CYP3A4CYP2D6CYP1A2 | |
| SCHEMBL11144559 | 0.79 | LMNA (0.43) | CYP2C9CYP3A4CYP1A2CYP2C19MAPT | |
| SCHEMBL11144562 | 0.79 | LMNA (0.43) | CYP2C9CYP3A4CYP1A2CYP2C19MAPT | |
| SCHEMBL11144321 | 0.77 | CYP3A4 (0.37) | CYP2C9CYP3A4CYP2D6CYP1A2CYP2C19 | |
| SCHEMBL11144324 | 0.77 | CYP3A4 (0.37) | CYP2C9CYP3A4CYP2D6CYP1A2CYP2C19 | |
| SCHEMBL11142795 | 0.73 | SLC6A4 (0.36) | CYP2C9SIGMAR1CYP3A4CYP2D6CYP2C19 | |
| SCHEMBL11142794 | 0.73 | SLC6A4 (0.36) | CYP2C9SIGMAR1CYP3A4CYP2D6CYP2C19 | |
| SCHEMBL32678868 | 0.73 | SIGMAR1 (0.38) | SIGMAR1CYP1A2MAPTKDM4EUSP2 | |
| SCHEMBL32678870 | 0.73 | SIGMAR1 (0.38) | SIGMAR1CYP1A2MAPTKDM4EUSP2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4420624-A | ANTIBIOTICS | THE UPJOHN COMPANY (US) | 1983-12-13 | — | — | US | disclosed |
| US-4413013-A | N-(((ARYLFORMAMIDOYL)METHYLAMINO)THIO)-N-SUBSTITUTED SULFONAMIDES | THE UPJOHN COMPANY (US) | 1983-11-01 | — | — | US | disclosed |
| US-4351771-A | Spectinomycin analogs and methods for the preparation thereof | THE UPJOHN COMPANY (US) | 1982-09-28 | — | — | US | disclosed |