Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.60 |
| ▸ | SRR | Q9GZT4 | 2/20 | 0.58 |
| ▸ | PSAT1 | Q9Y617 | 2/20 | 0.58 |
| ▸ | MME | P08473 | 8/20 | 0.54 |
| ▸ | ACE | P12821 | 2/20 | 0.54 |
| ▸ | CPA1 | P15085 | 2/20 | 0.53 |
| ▸ | CPA3 | P15088 | 2/20 | 0.53 |
| ▸ | FOLH1 | Q04609 | 1/20 | 0.53 |
| ▸ | CPB1 | P15086 | 1/20 | 0.53 |
| ▸ | CPB2 | Q96IY4 | 1/20 | 0.53 |
| ▸ | SLC1A3 | P43003 | 1/20 | 0.53 |
| ▸ | SLC1A2 | P43004 | 1/20 | 0.53 |
| ▸ | SLC1A1 | P43005 | 1/20 | 0.53 |
| ▸ | PPARG | P37231 | 2/20 | 0.53 |
| ▸ | PPARA | Q07869 | 2/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL5171909 | 0.89 | CYP1A2 (0.76) | CYP1A2MMECPA1CPA3FOLH1 | |
| SCHEMBL4738634 | 0.89 | CYP1A2 (0.76) | CYP1A2MMECPA1CPA3FOLH1 | |
| SCHEMBL558159 | 0.89 | CYP1A2 (0.76) | CYP1A2MMECPA1CPA3FOLH1 | |
| Hydrochloric Acid SCHEMBL23699291 | 0.87 | CYP1A2 (0.73) | CYP1A2SRRMMECPA1CPA3 | |
| SCHEMBL4738660 | 0.81 | SLC7A5 (0.61) | CYP1A2MMECPA1CPA3FOLH1 | |
| SCHEMBL4620825 | 0.81 | SLC7A5 (0.61) | CYP1A2MMECPA1CPA3FOLH1 | |
| SCHEMBL26076534 | 0.81 | PPARG (0.59) | CYP1A2CPA1CPA3FOLH1SLC1A3 | |
| Ethyl Chloride SCHEMBL1185929 | 0.81 | CYP1A2 (0.63) | CYP1A2MMECPA1CPA3FOLH1 | |
| SCHEMBL4619838 | 0.80 | CYP1A2 (0.52) | CYP1A2CPA1CPA3FOLH1CPB1 | |
| SCHEMBL21193997 | 0.80 | CYP1A2 (0.52) | CYP1A2MMEACECPA1CPA3 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2005030735-A1 | TRIAZINES DERIVATIVES AS CELL ADHESION INHIBITORS | RANBAXY LABORATORIES LIMITED (IN) | 2005-04-07 | — | — | WO | claimed |