Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CXCR1 | P25024 | 5/20 | 0.50 |
| ▸ | CXCR2 | P25025 | 5/20 | 0.50 |
| ▸ | PTGS1 | P23219 | 4/20 | 0.50 |
| ▸ | PTGS2 | P35354 | 4/20 | 0.50 |
| ▸ | LMNA | P02545 | 3/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.50 |
| ▸ | AKR1C3 | P42330 | 2/20 | 0.50 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.50 |
| ▸ | ALB | P02768 | 1/20 | 0.50 |
| ▸ | ESR1 | P03372 | 1/20 | 0.50 |
| ▸ | RARB | P10826 | 1/20 | 0.50 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.50 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.50 |
| ▸ | HTR2A | P28223 | 1/20 | 0.50 |
| ▸ | NR1I3 | Q14994 | 1/20 | 0.50 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.50 |
| ▸ | CXCL8 | P10145 | 1/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL24500947 | 0.82 | SLC7A5 (0.46) | — | |
| SCHEMBL8008897 | 0.81 | ALDH1A1 (0.47) | CXCR1CXCR2PTGS1PTGS2LMNA | |
| SCHEMBL24264697 | 0.81 | HPGD (0.56) | CXCR1CXCR2PTGS1PTGS2LMNA | |
| SCHEMBL13329804 | 0.81 | CNR2 (0.58) | LMNAHPGD | |
| SCHEMBL8128592 | 0.80 | CA1 (0.53) | CXCR1CXCR2PTGS1PTGS2LMNA | |
| SCHEMBL27059184 | 0.80 | HPGD (0.46) | CXCR1CXCR2PTGS1PTGS2LMNA | |
| Ibufenac SCHEMBL24244 | 0.78 | PTGS1 (0.60) | CXCR1CXCR2PTGS1PTGS2LMNA | |
| SCHEMBL241137 | 0.78 | POLB (0.58) | CXCR1CXCR2PTGS1PTGS2LMNA | |
| SCHEMBL11800587 | 0.78 | PTGS1 (0.55) | CXCR1CXCR2PTGS1PTGS2LMNA | |
| SCHEMBL171860 | 0.78 | HPGD (0.59) | LMNAHPGD |
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 |
|---|---|---|---|---|---|---|---|
| CN-108341733-B | Novel electronic salt system and reduction method of unsaturated hydrocarbon compound | 中国农业大学 | 2021-01-08 | — | — | CN | disclosed |