Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 7/20 | 0.49 |
| ▸ | PTGS1 | P23219 | 5/20 | 0.49 |
| ▸ | LMNA | P02545 | 2/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.49 |
| ▸ | AKR1C3 | P42330 | 2/20 | 0.49 |
| ▸ | CXCR1 | P25024 | 2/20 | 0.49 |
| ▸ | CXCR2 | P25025 | 2/20 | 0.49 |
| ▸ | CXCL8 | P10145 | 2/20 | 0.49 |
| ▸ | ALB | P02768 | 1/20 | 0.49 |
| ▸ | ESR1 | P03372 | 1/20 | 0.49 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.49 |
| ▸ | RARB | P10826 | 1/20 | 0.49 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.49 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.49 |
| ▸ | HTR2A | P28223 | 1/20 | 0.49 |
| ▸ | NR1I3 | Q14994 | 1/20 | 0.49 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.49 |
| ▸ | BLM | P54132 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL1394339 | 1.00 | PTGS2 (0.49) | PTGS2PTGS1LMNACYP2C9AKR1C3 | |
| SCHEMBL3155111 | 1.00 | PTGS2 (0.49) | PTGS2PTGS1LMNACYP2C9AKR1C3 | |
| SCHEMBL4483212 | 0.89 | GABRA1 (0.47) | PTGS2PTGS1LMNACYP2C9AKR1C3 | |
| SCHEMBL4480628 | 0.89 | GABRA1 (0.47) | PTGS2PTGS1LMNACYP2C9AKR1C3 | |
| SCHEMBL5016325 | 0.89 | GABRA1 (0.47) | PTGS2PTGS1LMNACYP2C9AKR1C3 | |
| Ibuprofen SCHEMBL1891683 | 0.88 | PTGS2 (0.71) | PTGS2PTGS1LMNACYP2C9AKR1C3 | |
| SCHEMBL5960824 | 0.86 | GABRA1 (0.42) | PTGS2PTGS1LMNACYP2C9AKR1C3 | |
| SCHEMBL5017117 | 0.86 | GABRA1 (0.42) | PTGS2PTGS1LMNACYP2C9AKR1C3 | |
| SCHEMBL10429886 | 0.86 | CYP2D6 (0.47) | PTGS2PTGS1CYP2C9CXCL8MMP1 | |
| SCHEMBL5983552 | 0.85 | PTGS2 (0.46) | PTGS2PTGS1LMNAAKR1C3CXCR1 |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0398288-B1 | Process for preparing optically active 2-arylalkanoic acids, in particular 2-arylpropionic acids | PUETTER MEDICE CHEM PHARM (DE) | 1995-10-18 | — | — | EP | disclosed |
| EP-0641304-A1 | STEREO-SELECTIVE SYNTHESIS OF 2-ARYL-PROPIONIC ACIDS OF HIGH OPTICAL PURITY BY USING CHIRAL OXAZOLINES | CHEMISCH BIOTECHNOLOGISCHE LABORATORIEN GMBH (DE) | 1995-03-08 | — | — | EP | disclosed |
| US-5380927-A | Process for preparing optically active 2-aryl-alkanoic acids, in particular 2-aryl-propionic acids | MEDICE CHEM.-PHARM. FABRIK PUTTER GMBH & CO. KG (DE) | 1995-01-10 | — | — | US | disclosed |
| US-5266723-A | Process for the preparation of optically active 2-aryl-alkanoic acids, especially 2-aryl-propionic acids | MEDICE, LTD., CHEM.-PHARM. FABRIK PUTTER GMBH & CO. KG (DE) | 1993-11-30 | — | — | US | disclosed |
| US-5248815-A | STEREO-SELECTIVE SYNTHESIS OF 2-ARYL-PROPIONIC ACIDS OF HIGH OPTICAL PURITY BY USING CHIRAL OXAZOLINES | PARADIES HENRICH H (DE) | 1993-09-28 | — | — | US | disclosed |
| WO-1993013046-A1 | STEREO-SELECTIVE SYNTHESIS OF 2-ARYL-PROPIONIC ACIDS OF HIGH OPTICAL PURITY BY USING CHIRAL OXAZOLINES | KUNICHEM, INC. (US) | 1993-07-08 | — | — | WO | disclosed |
| EP-0398288-A2 | Process for preparing optically active 2-arylalkanoic acids, in particular 2-arylpropionic acids | MEDICEChem.-Pharm. Fabrik Pütter GmbH & Co. KG (DE) | 1990-11-22 | — | — | EP | disclosed |
| EP-0158913-A2 | Process for the preparation of optically active alpha-arylalkanoic acids and intermediates thereof | ZAMBON S.p.A. (IT) | 1985-10-23 | — | — | EP | disclosed |