Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 9/20 | 0.48 |
| ▸ | CA1 | P00915 | 7/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | SLC1A3 | P43003 | 1/20 | 0.36 |
| ▸ | SLC1A2 | P43004 | 1/20 | 0.36 |
| ▸ | SLC1A1 | P43005 | 1/20 | 0.36 |
| ▸ | CES2 | O00748 | 1/20 | 0.36 |
| ▸ | CES1 | P23141 | 1/20 | 0.36 |
| ▸ | CTSK | P43235 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL28729498 | 0.96 | CA2 (0.53) | CA2CA1MAPK1NFKB1CYP3A4 | |
| Potassium Ion SCHEMBL28727543 | 0.96 | CA2 (0.48) | CA2CA1MAPK1NFKB1CYP3A4 | |
| SCHEMBL28727433 | 0.96 | CA2 (0.48) | CA2CA1MAPK1NFKB1CYP3A4 | |
| SCHEMBL28727668 | 0.90 | CA1 (0.53) | CA2CA1NFKB1SLC1A2SLC1A1 | |
| Potassium Ion SCHEMBL28938759 | 0.90 | CA1 (0.53) | CA2CA1NFKB1CES2CES1 | |
| SCHEMBL10430541 | 0.88 | CA2 (0.53) | CA2CA1NFKB1CES2CES1 | |
| SCHEMBL26907859 | 0.85 | TSHR (0.43) | CA2CA1MAPK1NFKB1CYP3A4 | |
| SCHEMBL5867043 | 0.82 | CA1 (0.38) | CA2CA1MAPK1NFKB1CYP3A4 | |
| Potassium Ion SCHEMBL21269836 | 0.82 | CA2 (0.47) | CA2CA1MAPK1NFKB1CYP3A4 | |
| SCHEMBL21269504 | 0.82 | CA2 (0.47) | CA2CA1MAPK1NFKB1CYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| CN-113874450-A | Liquid electrophotographic ink composition | 惠普发展公司，有限责任合伙企业 | 2021-12-31 | — | — | CN | claimed |
| CN-113874450-A | Liquid electrophotographic ink composition | 惠普发展公司，有限责任合伙企业 | 2021-12-31 | — | — | CN | disclosed |