Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES1 | P23141 | 2/20 | 0.39 |
| ▸ | CES2 | O00748 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.37 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | GPR84 | Q9NQS5 | 7/20 | 0.35 |
| ▸ | PPARG | P37231 | 7/20 | 0.35 |
| ▸ | PPARD | Q03181 | 7/20 | 0.35 |
| ▸ | PPARA | Q07869 | 7/20 | 0.35 |
| ▸ | HDAC11 | Q96DB2 | 5/20 | 0.35 |
| ▸ | TSHR | P16473 | 4/20 | 0.35 |
| ▸ | PTPN1 | P18031 | 3/20 | 0.35 |
| ▸ | TLR2 | O60603 | 2/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.35 |
| ▸ | FABP4 | P15090 | 2/20 | 0.35 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.35 |
| ▸ | SLC22A8 | Q8TCC7 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | ESR1 | P03372 | 1/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL28642380 | 0.92 | GPR84 (0.47) | CES1CES2ALDH1A1AKR1B1GPR84 | |
| SCHEMBL28340666 | 0.92 | GPR84 (0.47) | CES1CES2ALDH1A1AKR1B1GPR84 | |
| SCHEMBL5520433 | 0.85 | CES1 (0.36) | CES1CES2ALDH1A1TP53CA1 | |
| SCHEMBL5520436 | 0.85 | CES1 (0.36) | CES1CES2ALDH1A1TP53CA1 | |
| SCHEMBL704215 | 0.81 | FFAR3 (0.36) | ALDH1A1TDP1 | |
| SCHEMBL4345308 | 0.79 | EP300 (0.47) | ALDH1A1GPR84PPARGPPARDPPARA | |
| SCHEMBL2936003 | 0.78 | CES1 (0.38) | CES1CES2ALDH1A1AKR1B1TP53 | |
| SCHEMBL28340663 | 0.78 | CES2 (0.45) | CES1CES2ALDH1A1GPR84PPARG | |
| SCHEMBL28714897 | 0.78 | CES2 (0.41) | CES1CES2ALDH1A1AKR1B1GPR84 | |
| SCHEMBL25421551 | 0.77 | NAAA (0.46) | CES1CES2ALDH1A1GPR84PPARG |
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 |
|---|---|---|---|---|---|---|---|
| EP-2120960-A2 | NOVEL ß-LACTAM ANTIBIOTICS, METHOD FOR THE PRODUCTION THEREOF, AND USE THEREOF | Dritte Patentportfolio Beteiligungsgesellschaft mbH & Co.KG (DE) | 2009-11-25 | — | — | EP | disclosed |
| WO-2008092928-A2 | NOVEL ß-LACTAM ANTIBIOTICS, METHOD FOR THE PRODUCTION THEREOF, AND USE THEREOF | DRITTE PATENTPORTFOLIO BETEILIGUNGSGESELLSCHAFT MBH & CO. KG (DE) | 2008-08-07 | — | — | WO | disclosed |