Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 5/20 | 0.43 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.43 |
| ▸ | PTGS1 | P23219 | 3/20 | 0.42 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.42 |
| ▸ | AKR1C3 | P42330 | 2/20 | 0.42 |
| ▸ | CXCR1 | P25024 | 2/20 | 0.42 |
| ▸ | CXCR2 | P25025 | 2/20 | 0.42 |
| ▸ | ESR1 | P03372 | 2/20 | 0.42 |
| ▸ | ALB | P02768 | 1/20 | 0.42 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.42 |
| ▸ | RARB | P10826 | 1/20 | 0.42 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.42 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.42 |
| ▸ | HTR2A | P28223 | 1/20 | 0.42 |
| ▸ | NR1I3 | Q14994 | 1/20 | 0.42 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.42 |
| ▸ | CXCL8 | P10145 | 1/20 | 0.42 |
| ▸ | LDHA | P00338 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL9175395 | 0.93 | SRR (0.42) | TAAR1SLC6A2PTGS1PTGS2LMNA | |
| SCHEMBL9497974 | 0.91 | TAAR1 (0.57) | TAAR1SLC6A2ESR1ADRB3ESR2 | |
| SCHEMBL9898783 | 0.91 | TRPA1 (0.38) | TAAR1SLC6A2PTGS1PTGS2LMNA | |
| SCHEMBL9771947 | 0.90 | TAAR1 (0.54) | TAAR1SLC6A2HTR2ATSHRTRPA1 | |
| SCHEMBL9492753 | 0.89 | IDO1 (0.48) | PTGS1PTGS2LMNACYP2C9AKR1C3 | |
| SCHEMBL9899581 | 0.87 | SIGMAR1 (0.46) | LMNASIGMAR1 | |
| SCHEMBL9179601 | 0.85 | ALDH1A1 (0.41) | LMNAADRB3TRPA1 | |
| SCHEMBL9171681 | 0.84 | HTR2A (0.48) | SLC6A2PTGS1PTGS2LMNACYP2C9 | |
| SCHEMBL28334721 | 0.84 | ALOX15 (0.32) | TAAR1SLC6A2PTGS2LMNACYP2C9 | |
| SCHEMBL9170102 | 0.84 | IDO1 (0.44) | PTGS1PTGS2LMNACYP2C9AKR1C3 |
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 11 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0609737-B1 | Process for producing a halogenated butyl rubber | BAYER INC (CA) | 2000-06-07 | — | — | EP | claimed |
| EP-0609737-A2 | Process for producing a halogenated butyl rubber | BAYER RUBBER INC. (CA) | 1994-08-10 | — | — | EP | claimed |
| EP-1003900-B1 | A PROCESS FOR THE PREPARATION OF A TERTIARY PERESTER | AKZO NOBEL NV (NL) | 2002-10-02 | — | — | EP | disclosed |
| US-6268523-B1 | CONTACTING ACYL COMPOUND WITH TERTIARY HYDROPEROXIDE IN PRESENCE OF ENZYME CATALYST TO PRODUCE PERESTER | AKZO NOBEL NV (NL) | 2001-07-31 | — | — | US | disclosed |
| EP-1003900-A1 | A PROCESS FOR THE PREPARATION OF A TERTIARY PERESTER | Akzo Nobel N.V. (NL) | 2000-05-31 | — | — | EP | disclosed |
| WO-1999005305-A1 | A PROCESS FOR THE PREPARATION OF A TERTIARY PERESTER | AKZO NOBEL N.V. (NL) | 1999-02-04 | — | — | WO | disclosed |
| EP-0267759-B1 | OXIDATION PROCESS OF AROMATIC COMPOUNDS | KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) | 1993-03-10 | — | — | EP | disclosed |
| US-4825007-A | Oxidation process of aromatic compounds | KUREHA KAGAKU KOGYO K.K. (JP) | 1989-04-25 | — | — | US | disclosed |
| EP-0267759-A2 | Oxidation process of aromatic compounds | KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) | 1988-05-18 | — | — | EP | disclosed |
| US-4129704-A | Polymerization of vinyl monomers employing a diperoxyester mixture composition prepared by reacting dihydroperoxide and peroxyester forming carbonyl compounds | PENNWALT CORPORATION (US) | 1978-12-12 | — | — | US | disclosed |
| US-4097408-A | FROM DIHYDOPEROXIDE AND CARBONYL COMPOUND, POLYMERIZATION CATALYSTS | PENNWALT CORPORATION (US) | 1978-06-27 | — | — | US | disclosed |