Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CACNA1B | Q00975 | 4/20 | 0.38 |
| ▸ | SLC9A1 | P19634 | 1/20 | 0.37 |
| ▸ | EED | O75530 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 3/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | BCAT2 | O15382 | 1/20 | 0.32 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.32 |
| ▸ | SLC6A9 | P48067 | 1/20 | 0.32 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.32 |
| ▸ | DPP4 | P27487 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | NR1I2 | O75469 | 2/20 | 0.31 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.31 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 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 | |
|---|---|---|---|---|
| SCHEMBL8494381 | 0.86 | LMNA (0.37) | CACNA1BSLC9A1EEDLMNAPOLB | |
| SCHEMBL8491664 | 0.83 | — | — | |
| SCHEMBL8495604 | 0.75 | POLB (0.36) | SLC9A1EEDLMNAPOLBBCAT2 | |
| SCHEMBL8489221 | 0.74 | SLC9A1 (0.40) | CACNA1BSLC9A1EEDLMNANR1I2 | |
| SCHEMBL8391795 | 0.66 | CYP2C9 (0.39) | SLC9A1HSD11B1 | |
| SCHEMBL8606545 | 0.65 | LMNA (0.40) | CACNA1BSLC9A1EEDLMNABCAT2 | |
| SCHEMBL8606607 | 0.65 | LMNA (0.43) | CACNA1BSLC9A1EEDLMNABCAT2 | |
| SCHEMBL8389458 | 0.64 | MGLL (0.41) | P2RX7HSD11B1 | |
| SCHEMBL8607785 | 0.61 | LMNA (0.37) | CACNA1BSLC9A1EEDLMNAPOLB | |
| SCHEMBL8608708 | 0.61 | LMNA (0.38) | CACNA1BSLC9A1EEDLMNABCAT2 |
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 |
|---|---|---|---|---|---|---|---|
| US-5859283-A | TERTIARY-BUTYL 3-CYCLOALKYL-3-OXOPROPIONATE | RHONE-POULENC AGRICULTURE LIMITED (GB) | 1999-01-12 | — | — | US | disclosed |
| US-5747424-A | HEATING AN AROMATIC DIKETONE WITH A SALT OF HYDROXYLAMINE IN A SOLVENT | RHONE-POULENC AGRICULTURE LTD. (GB) | 1998-05-05 | — | — | US | disclosed |