Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAS2R14 | Q9NYV8 | 1/20 | 0.38 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.34 |
| ▸ | CTSS | P25774 | 1/20 | 0.34 |
| ▸ | AR | P10275 | 1/20 | 0.33 |
| ▸ | DHODH | Q02127 | 1/20 | 0.33 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.33 |
| ▸ | HSD11B1 | P28845 | 3/20 | 0.32 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.31 |
| ▸ | CES1 | P23141 | 1/20 | 0.31 |
| ▸ | ACHE | P22303 | 1/20 | 0.30 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL260225 | 0.81 | LMNA (0.36) | ARHSD11B1 | |
| SCHEMBL13726323 | 0.77 | TRPA1 (0.37) | ACHE | |
| SCHEMBL11523592 | 0.75 | AR (0.37) | TAS2R14ARHSD11B1P2RX7ACHE | |
| SCHEMBL261312 | 0.74 | ALDH1A1 (0.39) | NOTUMARHSD11B1CES1 | |
| SCHEMBL4113607 | 0.74 | ALDH1A1 (0.32) | — | |
| SCHEMBL6630838 | 0.73 | TAS2R14 (0.46) | TAS2R14NOTUMCTSSDHODHHDAC6 | |
| SCHEMBL28772799 | 0.73 | ALDH1A1 (0.31) | — | |
| Hydrochloric Acid SCHEMBL18936435 | 0.72 | ALDH1A1 (0.38) | ARHSD11B1CES1 | |
| Hydrochloric Acid SCHEMBL9659775 | 0.72 | ALDH1A1 (0.42) | ARHSD11B1CES1 | |
| Fluoride Ion SCHEMBL11774111 | 0.72 | ALDH1A1 (0.38) | NOTUMARHSD11B1CES1 |
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-4132737-A | ENZYME INHIBITORS | ELI LILLY AND COMPANY (US) | 1979-01-02 | — | — | US | disclosed |