Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | SRC | P12931 | 1/20 | 0.40 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 3/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | CES2 | O00748 | 1/20 | 0.38 |
| ▸ | CES1 | P23141 | 1/20 | 0.38 |
| ▸ | AKT1 | P31749 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | ESR1 | P03372 | 1/20 | 0.37 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL5837445 | 0.91 | KMT2A (0.47) | CYP2C19CYP2D6HCAR2ALDH1A1ALOX15 | |
| SCHEMBL2886387 | 0.88 | CYP2C19 (0.43) | CYP2C19CYP2D6SRCHCAR2ALDH1A1 | |
| SCHEMBL439168 | 0.88 | ATM (0.41) | CYP2C19HCAR2ALDH1A1ALOX15LMNA | |
| SCHEMBL21294950 | 0.85 | MAPT (0.41) | CYP2C19HCAR2ALDH1A1LMNAKMT2A | |
| SCHEMBL3828726 | 0.85 | CYP2D6 (0.44) | CYP2C19CYP2D6SRCHCAR2LMNA | |
| SCHEMBL11216512 | 0.85 | CYP2D6 (0.42) | CYP2C19CYP2D6SRCHCAR2ALDH1A1 | |
| SCHEMBL299987 | 0.85 | THRB (0.41) | CYP2C19CYP2D6SRCHCAR2ALDH1A1 | |
| SCHEMBL61038 | 0.85 | CYP3A4 (0.50) | CYP2C19CYP2D6SRCHCAR2ALDH1A1 | |
| SCHEMBL8861561 | 0.84 | ALDH1A1 (0.47) | CYP2C19SRCALDH1A1ALOX15LMNA | |
| SCHEMBL29190248 | 0.83 | TSHR (0.52) | CYP2C19ALDH1A1LMNAKMT2ACES2 |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4889894-A | Compatible polymer mixtures | ROHM GMBH (DE) | 1989-12-26 | — | — | US | claimed |
| US-7824899-B2 | Preparation of enantiomerically enriched amines and amides by enzymatic resolution using a sulfonylacetic acid ester as acyl donor | EVONIK DEGUSSA GMBH (DE) | 2010-11-02 | — | — | US | disclosed |
| EP-1870475-B1 | Process for the preparation of optically active amines and amides employing a hydrolase and sulfonyl acetic acid ester as the acyl donor | EVONIK DEGUSSA GMBH (DE) | 2008-12-10 | — | — | EP | disclosed |
| US-20070298471-A1 | PROCESS FOR THE PREPARATION OF ENANTIOMERICALLY ENRICHED AMINES AND AMIDES BY ENZYMATIC RESOLUTION | DEGUSSA GMBH (DE) | 2007-12-27 | — | — | US | disclosed |
| EP-1870475-A1 | Process for the preparation of optically active amines and amides employing a hydrolase and sulfonyl acetic acid ester as the acyl donor | Evonik Degussa GmbH (DE) | 2007-12-26 | — | — | EP | disclosed |
| US-5023123-A | Molding materials | ROHM GMBH (DE) | 1991-06-11 | — | — | US | disclosed |
| US-4889894-A | Compatible polymer mixtures | ROHM GMBH (DE) | 1989-12-26 | — | — | US | disclosed |
| EP-0257419-A1 | Process for the preparation of antibacterial 7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene derivatives | HOECHST AKTIENGESELLSCHAFT (DE) | 1988-03-02 | — | — | EP | disclosed |
| US-4330665-A | Process for the preparation of aromatic polycarbonates | BAYER AKTIENGESELLSCHAFT (DE) | 1982-05-18 | — | — | US | disclosed |