Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 2/20 | 0.62 |
| ▸ | NFKB1 | P19838 | 3/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.44 |
| ▸ | TSHR | P16473 | 2/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.44 |
| ▸ | CA1 | P00915 | 2/20 | 0.43 |
| ▸ | GPR84 | Q9NQS5 | 7/20 | 0.38 |
| ▸ | GRIK1 | P39086 | 2/20 | 0.37 |
| ▸ | GRIK2 | Q13002 | 2/20 | 0.37 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | LCK | P06239 | 1/20 | 0.35 |
| ▸ | PPARD | Q03181 | 1/20 | 0.35 |
| ▸ | ZDHHC20 | Q5W0Z9 | 1/20 | 0.35 |
| ▸ | ZDHHC2 | Q9UIJ5 | 1/20 | 0.35 |
| ▸ | SLC1A2 | P43004 | 1/20 | 0.35 |
| ▸ | SLC1A1 | P43005 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL7878112 | 1.00 | CA2 (0.62) | CA2NFKB1CYP3A4TSHRNPSR1 | |
| SCHEMBL4365094 | 1.00 | CA2 (0.62) | CA2NFKB1CYP3A4TSHRNPSR1 | |
| SCHEMBL6655133 | 1.00 | CA2 (0.62) | CA2NFKB1CYP3A4TSHRNPSR1 | |
| SCHEMBL9629209 | 0.95 | CA2 (0.60) | CA2NFKB1CYP3A4TSHRNPSR1 | |
| Mercaptopropionic Acid SCHEMBL8075201 | 0.93 | CA2 (0.54) | CA2NFKB1CYP3A4TSHRNPSR1 | |
| SCHEMBL11583460 | 0.92 | CA2 (0.53) | CA2NPSR1FFAR1MAPT | |
| SCHEMBL9068224 | 0.89 | CA2 (0.59) | CA2NFKB1CYP3A4TSHRNPSR1 | |
| SCHEMBL9247328 | 0.89 | CA2 (0.59) | CA2NFKB1CYP3A4TSHRNPSR1 | |
| SCHEMBL11879863 | 0.89 | CA2 (0.59) | CA2NFKB1CYP3A4TSHRNPSR1 | |
| SCHEMBL5829480 | 0.89 | CA2 (0.68) | CA2NFKB1CYP3A4TSHRNPSR1 |
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-5566543-A | FILTERABILITY OF COMBUSTION PRODUCTS OF GAS GENERATION FOR INFLATABLE DEVICES, VINYL CHLORIDE POLYMER AND ALKALI METAL SALT OXIDIZER AND NUCLEATING AGENT | MORTON INTERNATIONAL, INC. (US) | 1996-10-22 | — | — | US | disclosed |
| EP-0655429-A1 | Improved PVC-based gas generant for hybrid gas generators | MORTON INTERNATIONAL, INC. (US) | 1995-05-31 | — | — | EP | disclosed |