Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 8/20 | 0.61 |
| ▸ | CAMK2A | Q9UQM7 | 3/20 | 0.60 |
| ▸ | ABCB11 | O95342 | 2/20 | 0.55 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.55 |
| ▸ | NR1I3 | Q14994 | 2/20 | 0.55 |
| ▸ | PPARG | P37231 | 1/20 | 0.55 |
| ▸ | CXCL8 | P10145 | 3/20 | 0.54 |
| ▸ | TTR | P02766 | 2/20 | 0.54 |
| ▸ | AKR1B10 | O60218 | 1/20 | 0.54 |
| ▸ | UGT1A9 | O60656 | 1/20 | 0.54 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.54 |
| ▸ | MT-CO2 | P00403 | 1/20 | 0.54 |
| ▸ | ALB | P02768 | 1/20 | 0.54 |
| ▸ | UGT1A6 | P19224 | 1/20 | 0.54 |
| ▸ | UGT1A1 | P22309 | 1/20 | 0.54 |
| ▸ | CXCR1 | P25024 | 1/20 | 0.54 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.54 |
| ▸ | AGTR2 | P50052 | 1/20 | 0.54 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.54 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL10796562 | 0.90 | CAMK2A (0.75) | PTGS2CAMK2AABCB11PTGS1NR1I3 | |
| SCHEMBL10797038 | 0.86 | CAMK2A (0.77) | PTGS2CAMK2AABCB11PTGS1NR1I3 | |
| SCHEMBL1033041 | 0.82 | PTGS2 (0.71) | PTGS2CAMK2AABCB11PTGS1NR1I3 | |
| SCHEMBL1031441 | 0.82 | PTGS2 (0.74) | PTGS2CAMK2AABCB11PTGS1NR1I3 | |
| SCHEMBL1032030 | 0.80 | PTGS2 (0.56) | PTGS2CAMK2AABCB11PTGS1NR1I3 | |
| 4',5-Dihydroxy-Diclofenac SCHEMBL7162002 | 0.79 | CAMK2A (0.81) | PTGS2CAMK2AABCB11PTGS1NR1I3 | |
| SCHEMBL1032830 | 0.79 | PTGS2 (0.54) | PTGS2CAMK2AABCB11PTGS1NR1I3 | |
| SCHEMBL1032535 | 0.77 | PTGS2 (0.87) | PTGS2CAMK2AABCB11PTGS1NR1I3 | |
| Lumiracoxib SCHEMBL6063194 | 0.76 | PTGS2 (0.87) | PTGS2CAMK2AABCB11PTGS1NR1I3 | |
| SCHEMBL30911087 | 0.76 | MEN1 (0.52) | CAMK2ACXCL8 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4711879-A | IMMUNO-MODULATING ACTIVITY | CIBA-GEIGY CORPORATION (US) | 1987-12-08 | — | — | US | claimed |
| US-4640911-A | IMMUNOSTIMULANTS, VIRICIDES SUCH AS HERPES SIMPLEX | CIBA-GEIGY CORPORATION (US) | 1987-02-03 | — | — | US | claimed |
| EP-0163286-A2 | Acylated sugars, method for their preparation and their use | CIBA-GEIGY AG (CH) | 1985-12-04 | — | — | EP | claimed |
| US-4640911-A | IMMUNOSTIMULANTS, VIRICIDES SUCH AS HERPES SIMPLEX | CIBA-GEIGY CORPORATION (US) | 1987-02-03 | — | — | US | disclosed |