Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 5/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.52 |
| ▸ | GPR84 | Q9NQS5 | 2/20 | 0.46 |
| ▸ | ESR1 | P03372 | 2/20 | 0.45 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.45 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.45 |
| ▸ | TACR2 | P21452 | 2/20 | 0.45 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.45 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.45 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | SHBG | P04278 | 1/20 | 0.45 |
| ▸ | TP53 | P04637 | 1/20 | 0.45 |
| ▸ | HSPD1 | P10809 | 1/20 | 0.45 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.45 |
| ▸ | HTR2C | P28335 | 1/20 | 0.45 |
| ▸ | HSPE1 | P61604 | 1/20 | 0.45 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL1777432 | 1.00 | PTGS2 (0.55) | PTGS2CYP3A4GPR84ESR1ADRA2A | |
| SCHEMBL19358108 | 1.00 | PTGS2 (0.55) | PTGS2CYP3A4GPR84ESR1ADRA2A | |
| SCHEMBL19357908 | 1.00 | PTGS2 (0.55) | PTGS2CYP3A4GPR84ESR1ADRA2A | |
| SCHEMBL19358002 | 1.00 | PTGS2 (0.55) | PTGS2CYP3A4GPR84ESR1ADRA2A | |
| SCHEMBL19358152 | 1.00 | PTGS2 (0.55) | PTGS2CYP3A4GPR84ESR1ADRA2A | |
| SCHEMBL19358148 | 1.00 | PTGS2 (0.55) | PTGS2CYP3A4GPR84ESR1ADRA2A | |
| SCHEMBL8436317 | 0.98 | PTGS2 (0.54) | PTGS2CYP3A4GPR84ESR1ADRA2A | |
| SCHEMBL9355504 | 0.96 | PTGS2 (0.52) | PTGS2CYP3A4GPR84ESR1ADRA2A | |
| SCHEMBL6460367 | 0.94 | PTGS2 (0.48) | PTGS2CYP3A4GPR84ESR1ADRA2A | |
| SCHEMBL146982 | 0.91 | HPGD (0.48) | PTGS2CYP3A4GPR84ESR1ADRA2A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2019053540-A1 | METHODS OF PRODUCING ALPHA, BETA-UNSATURATED CARBOXYLIC ACID SALTS FROM ALKANES AND CARBON DIOXIDE | SABIC GLOBAL TECHNOLOGIES B.V. (NL) | 2019-03-21 | — | — | WO | disclosed |
| WO-2019053541-A1 | ACRYLATES THROUGH OLEFIN/CARBON DIOXIDE COUPLING | SABIC GLOBAL TECHNOLOGIES B.V. (NL) | 2019-03-21 | — | — | WO | disclosed |
| WO-2017158469-A1 | METHODS OF MAKING ALPHA, BETA-UNSATURATED CARBOXYLIC ACIDS OR SALTS | SABIC GLOBAL TECHNOLOGIES B.V. (NL) | 2017-09-21 | — | — | WO | disclosed |