Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 4/20 | 0.42 |
| ▸ | STS | P08842 | 8/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 3/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.38 |
| ▸ | RNASEL | Q05823 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.38 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.38 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL9307869 | 0.88 | ESR1 (0.43) | ESR1STSSMN1; SMN2NPC1RAB9A | |
| SCHEMBL9307486 | 0.80 | KDM4E (0.41) | RAB9ALMNACYP1A2TSHRCYP2C19 | |
| SCHEMBL9306442 | 0.78 | KDM4E (0.42) | SMN1; SMN2LMNACYP1A2TSHRCYP2C19 | |
| SCHEMBL9307908 | 0.75 | CHUK (0.45) | SMN1; SMN2LMNACYP1A2TSHRCYP2C19 | |
| SCHEMBL5711602 | 0.74 | PLA2G4B (0.48) | ESR1SMN1; SMN2NPC1RAB9ALMNA | |
| SCHEMBL9308590 | 0.73 | KDM4E (0.42) | RAB9ATSHRMEN1MAPTKMT2A | |
| SCHEMBL4400571 | 0.71 | KDM4E (0.56) | ESR1STSSMN1; SMN2LMNACYP1A2 | |
| SCHEMBL9308620 | 0.71 | KDM4E (0.44) | SMN1; SMN2LMNACYP1A2TSHRCYP2C19 | |
| SCHEMBL15127702 | 0.70 | HPGD (0.50) | SMN1; SMN2RAB9ALMNATSHRCYP3A4 | |
| Octane SCHEMBL3326752 | 0.69 | NAAA (0.63) | LMNATSHRCYP3A4MEN1NR1I2 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1051759-C | Method for preparing aryl ethanolamine | SCHERING CORP (US) | 2000-04-26 | — | — | CN | disclosed |
| CN-1223250-A | Process for preparing acetals Hemi-acetals, and hydrates of arylglyoxals | SCHERING CORP (US) | 1999-07-21 | — | — | CN | disclosed |
| EP-0548224-B1 | PROCESS FOR PREPARING ALBUTEROL, ACETAL, HEMI-ACETAL, AND HYDRATES OF ARYLGLYOXAL INTERMEDIATES THEREOF | SCHERING CORP (US) | 1994-11-23 | — | — | EP | disclosed |
| US-5283359-A | Process for preparing albuterol, acetal, hemi-acetal, and hydrates of arylglyoxal intermediates thereof | SCHERING CORP. (US) | 1994-02-01 | — | — | US | disclosed |
| EP-0548224-A1 | PROCESS FOR PREPARING ALBUTEROL, ACETAL, HEMI-ACETAL, AND HYDRATES OF ARYLGLYOXAL INTERMEDIATES THEREOF. | SCHERING CORP (US) | 1993-06-30 | — | — | EP | disclosed |
| WO-1992004314-A2 | PROCESS FOR PREPARING ALBUTEROL, ACETAL, HEMI-ACETAL, AND HYDRATES OF ARYLGLYOXAL INTERMEDIATES THEREOF | SCHERING CORPORATION (US) | 1992-03-19 | — | — | WO | disclosed |