Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 3/20 | 0.42 |
| ▸ | HDAC2 | Q92769 | 3/20 | 0.42 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.42 |
| ▸ | AKR1A1 | P14550 | 1/20 | 0.42 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.42 |
| ▸ | HTR2A | P28223 | 1/20 | 0.42 |
| ▸ | HTR2C | P28335 | 1/20 | 0.42 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.42 |
| ▸ | HRH1 | P35367 | 1/20 | 0.42 |
| ▸ | DRD3 | P35462 | 1/20 | 0.42 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 3/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.40 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | HDAC7 | Q8WUI4 | 3/20 | 0.37 |
| ▸ | HDAC8 | Q9BY41 | 3/20 | 0.37 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL150481 | 0.97 | HDAC1 (0.43) | HDAC1HDAC2CHRM1AKR1A1CHRM3 | |
| SCHEMBL3385580 | 0.94 | HDAC1 (0.42) | HDAC1HDAC2CHRM1AKR1A1CHRM3 | |
| Ethylene SCHEMBL23700090 | 0.92 | HDAC1 (0.40) | HDAC1HDAC2CHRM1AKR1A1CHRM3 | |
| Propene SCHEMBL23700062 | 0.85 | HDAC1 (0.36) | HDAC1HDAC2CHRM1AKR1A1CHRM3 | |
| SCHEMBL462373 | 0.81 | TP53 (0.46) | TSHRTP53FDPSCA1CA2 | |
| Tetrabuthylammonium SCHEMBL28466197 | 0.80 | SLC22A1 (0.48) | TSHRCYP3A4TP53RECQL | |
| SCHEMBL1270580 | 0.79 | TP53 (0.56) | TP53FDPSCA1CA2 | |
| Acrylamide SCHEMBL6677497 | 0.79 | TSHR (0.42) | HDAC1HDAC2CHRM1AKR1A1CHRM3 | |
| SCHEMBL6241631 | 0.77 | TP53 (0.54) | TP53FDPSCA1CA2 | |
| SCHEMBL563944 | 0.77 | TP53 (0.54) | TP53FDPSCA1CA2 |
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-9583789-B2 | Non-aqueous electrolyte secondary battery | NEC CORPORATION (JP) | 2017-02-28 | — | — | US | disclosed |
| US-20150155597-A1 | NON-AQUEOUS ELECTROLYTE SECONDARY BATTERY | NEC CORPORATION (JP) | 2015-06-04 | — | — | US | disclosed |