Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS1 | P23219 | 4/20 | 0.44 |
| ▸ | PTGS2 | P35354 | 4/20 | 0.44 |
| ▸ | TSHR | P16473 | 4/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.44 |
| ▸ | AKR1C3 | P42330 | 2/20 | 0.44 |
| ▸ | CXCR1 | P25024 | 2/20 | 0.44 |
| ▸ | CXCR2 | P25025 | 2/20 | 0.44 |
| ▸ | ALB | P02768 | 1/20 | 0.44 |
| ▸ | ESR1 | P03372 | 1/20 | 0.44 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.44 |
| ▸ | RARB | P10826 | 1/20 | 0.44 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.44 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.44 |
| ▸ | HTR2A | P28223 | 1/20 | 0.44 |
| ▸ | NR1I3 | Q14994 | 1/20 | 0.44 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.44 |
| ▸ | CXCL8 | P10145 | 1/20 | 0.44 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.44 |
| ▸ | BLM | P54132 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL11667905 | 0.87 | PTGS1 (0.40) | PTGS1PTGS2TSHRLMNACYP2C9 | |
| SCHEMBL11667907 | 0.85 | PTGS1 (0.37) | PTGS1PTGS2TSHRLMNACYP2C9 | |
| SCHEMBL16859990 | 0.81 | PTGS1 (0.49) | PTGS1PTGS2TSHRLMNACYP2C9 | |
| SCHEMBL30242220 | 0.81 | PTGS1 (0.49) | PTGS1PTGS2TSHRLMNACYP2C9 | |
| SCHEMBL15655076 | 0.80 | FAAH (0.47) | PTGS1PTGS2TSHRLMNACYP2C9 | |
| SCHEMBL14850480 | 0.79 | ALDH1A1 (0.62) | TSHRCYP2C9ALDH1A1 | |
| SCHEMBL2927687 | 0.79 | ALDH1A1 (0.62) | TSHRCYP2C9ALDH1A1 | |
| SCHEMBL17836946 | 0.78 | PTGS1 (0.45) | PTGS1PTGS2TSHRLMNACYP2C9 | |
| SCHEMBL11667912 | 0.76 | PTGS1 (0.41) | PTGS1PTGS2TSHRLMNACYP2C9 | |
| SCHEMBL2139313 | 0.76 | PTGS1 (0.53) | PTGS1PTGS2TSHRLMNACYP2C9 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0414207-B1 | Method for preparing alpha-(-4-isobutylphenyl) propionic acid or its precursor | NIPPON PETROCHEMICALS CO LTD (JP) | 1994-08-03 | — | — | EP | claimed |
| EP-0374850-B1 | Method for preparing alpha-(4-isobutylphenyl)propionic acid or its precursor | NIPPON PETROCHEMICALS CO LTD (JP) | 1994-03-09 | — | — | EP | claimed |
| EP-0347939-B1 | METHOD FOR PREPARING ALPHA-(4-ISOBUTYLPHENYL) PROPIONIC ACID OR ITS PRECURSOR | NIPPON PETROCHEMICALS CO., LTD. (JP) | 1993-08-25 | — | — | EP | claimed |