Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 9/20 | 0.44 |
| ▸ | AKR1C3 | P42330 | 8/20 | 0.44 |
| ▸ | PTGS1 | P23219 | 7/20 | 0.44 |
| ▸ | AKR1C2 | P52895 | 7/20 | 0.44 |
| ▸ | TSHR | P16473 | 2/20 | 0.44 |
| ▸ | SLC22A6 | Q4U2R8 | 2/20 | 0.44 |
| ▸ | CDC42 | P60953 | 1/20 | 0.44 |
| ▸ | RAC1 | P63000 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.41 |
| ▸ | CXCR1 | P25024 | 2/20 | 0.41 |
| ▸ | CXCR2 | P25025 | 2/20 | 0.41 |
| ▸ | ALB | P02768 | 1/20 | 0.41 |
| ▸ | ESR1 | P03372 | 1/20 | 0.41 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.41 |
| ▸ | RARB | P10826 | 1/20 | 0.41 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.41 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.41 |
| ▸ | HTR2A | P28223 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL10345923 | 0.79 | LMNA (0.41) | TSHRCYP1A2LMNACYP2C9ADRB3 | |
| SCHEMBL21775493 | 0.77 | KMT2A (0.41) | LMNAADRB3 | |
| SCHEMBL27579668 | 0.77 | KMT2A (0.60) | PTGS2AKR1C3PTGS1AKR1C2TSHR | |
| SCHEMBL21775539 | 0.75 | AOC3 (0.39) | ADRB3CNR2 | |
| SCHEMBL10881708 | 0.74 | PTGS2 (0.52) | PTGS2AKR1C3PTGS1AKR1C2TSHR | |
| SCHEMBL9484088 | 0.74 | LMNA (0.53) | TSHRCYP1A2LMNANFKB1BLM | |
| SCHEMBL11392495 | 0.73 | PABPC1 (0.35) | ADRB3PMP22CNR2 | |
| SCHEMBL2585659 | 0.73 | PPARG (0.39) | CYP1A2LMNAADRB3CNR2CYP2C19 | |
| SCHEMBL28243247 | 0.72 | PTGS2 (0.50) | PTGS2AKR1C3PTGS1AKR1C2TSHR | |
| SCHEMBL20552868 | 0.72 | PPARG (0.43) | TSHRCYP1A2LMNAADRB3 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0256586-B1 | PROCESS FOR THE PREPARATION OF ESTERS OF 4-(2,3-EPOXYPROPOXY)PHENYLACETIC ACID AND 4-(2-HYDROXY-3-ISOPROPYLAMINO-PROPOXY)PHENYLACETIC ACID AND/OR ATENOLOL IN STEREOSPECIFIC FORM | GIST-BROCADES N.V. (NL) | 1992-05-13 | — | — | EP | disclosed |