Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR5 | P51681 | 1/20 | 0.32 |
| ▸ | GPR119 | Q8TDV5 | 3/20 | 0.31 |
| ▸ | MAOA | P21397 | 1/20 | 0.31 |
| ▸ | MAOB | P27338 | 1/20 | 0.31 |
| ▸ | CA12 | O43570 | 3/20 | 0.31 |
| ▸ | CA1 | P00915 | 3/20 | 0.31 |
| ▸ | CA2 | P00918 | 3/20 | 0.31 |
| ▸ | CA9 | Q16790 | 3/20 | 0.31 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.30 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.30 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.30 |
| ▸ | RELA | Q04206 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL27332797 | 0.89 | S1PR3 (0.37) | CA12CA1CA2CA9S1PR3 | |
| SCHEMBL27330054 | 0.88 | NR1D1 (0.31) | GPR119 | |
| SCHEMBL27311932 | 0.88 | SSTR4 (0.34) | GPR119 | |
| SCHEMBL27336559 | 0.87 | GPR119 (0.32) | GPR119CA12CA1CA2CA9 | |
| SCHEMBL27310843 | 0.87 | S1PR3 (0.40) | CA12CA1CA2CA9S1PR3 | |
| SCHEMBL27325460 | 0.86 | JAK2 (0.31) | — | |
| SCHEMBL27309891 | 0.85 | GPR119 (0.35) | GPR119 | |
| SCHEMBL27331213 | 0.84 | GPR119 (0.33) | GPR119CA12CA1CA2CA9 | |
| SCHEMBL27325489 | 0.79 | ALDH1A1 (0.40) | CA12CA1CA2CA9 | |
| SCHEMBL27313129 | 0.77 | GPR119 (0.37) | CCR5GPR119 |
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-1050023-A | The method for preparing cephalosporin derivative | BEECHAM GROUP PLC (GB) | 1991-03-20 | — | — | CN | claimed |
| CN-1050023-A | The method for preparing cephalosporin derivative | BEECHAM GROUP PLC (GB) | 1991-03-20 | — | — | CN | disclosed |