Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SCN5A | Q14524 | 3/20 | 0.37 |
| ▸ | SCN9A | Q15858 | 3/20 | 0.37 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.34 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.34 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | HTR2B | P41595 | 1/20 | 0.34 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.34 |
| ▸ | KIF11 | P52732 | 1/20 | 0.33 |
| ▸ | SLC22A2 | O15244 | 1/20 | 0.33 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.33 |
| ▸ | PGR | P06401 | 1/20 | 0.33 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL2073778 | 0.81 | CYP3A4 (0.43) | SCN5ASCN9AHSP90AA1CYP3A4OPRK1 | |
| SCHEMBL15564307 | 0.78 | SCN5A (0.40) | SCN5ASCN9AHSP90AA1CYP3A4OPRK1 | |
| SCHEMBL2073783 | 0.76 | MMP1 (0.37) | SCN5ASCN9ACYP3A4OPRK1MEN1 | |
| SCHEMBL11804628 | 0.73 | LMNA (0.36) | HSP90AA1CYP3A4OPRK1LMNACHRM2 | |
| SCHEMBL11794861 | 0.72 | CYP19A1 (0.35) | HSP90AA1CYP3A4LMNAALOX15 | |
| SCHEMBL28833568 | 0.72 | SCN5A (0.50) | SCN5ASCN9ACYP3A4OPRK1MEN1 | |
| SCHEMBL11846314 | 0.71 | TSHR (0.43) | CYP3A4MEN1LMNACHRM2KMT2A | |
| SCHEMBL8978824 | 0.69 | ESR1 (0.53) | SCN5ASCN9AMEN1KMT2AGAA | |
| SCHEMBL4740369 | 0.69 | ESR1 (0.53) | SCN5ASCN9AMEN1KMT2AGAA | |
| SCHEMBL10448023 | 0.69 | ESR1 (0.53) | SCN5ASCN9AMEN1KMT2AGAA |
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-7863294-B2 | Heterocycle derivatives as histone deacetylase (HDAC) inhibitors | INSTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P. ANGELETTI SPA (IT) | 2011-01-04 | — | — | US | disclosed |