Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 7/20 | 0.50 |
| ▸ | CYSLTR2 | Q9NS75 | 3/20 | 0.48 |
| ▸ | CYSLTR1 | Q9Y271 | 3/20 | 0.48 |
| ▸ | PPARG | P37231 | 3/20 | 0.48 |
| ▸ | HTR2A | P28223 | 1/20 | 0.44 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.43 |
| ▸ | HTR2B | P41595 | 1/20 | 0.43 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.43 |
| ▸ | CSNK1E | P49674 | 1/20 | 0.43 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL5482450 | 0.79 | CYP1A2 (0.50) | CYSLTR2CYSLTR1PPARGMEN1NR1I2 | |
| SCHEMBL27297827 | 0.76 | LTB4R (0.54) | MEN1LMNACYP3A4MAPTKMT2A | |
| SCHEMBL11598812 | 0.76 | CYSLTR2 (0.50) | CYSLTR2CYSLTR1PPARGMEN1NR1I2 | |
| SCHEMBL26181865 | 0.76 | S1PR1 (0.60) | SIGMAR1HTR2ACSNK1EKCNH2 | |
| SCHEMBL29017813 | 0.76 | HTR2A (0.57) | SIGMAR1HTR2ALMNACHRM2CYP3A4 | |
| SCHEMBL8781026 | 0.74 | CYP1A2 (0.47) | PPARG | |
| SCHEMBL7771017 | 0.74 | CYSLTR2 (0.55) | CYSLTR2CYSLTR1HTR2ASLC2A1CSNK1E | |
| SCHEMBL10602463 | 0.74 | CYSLTR2 (0.55) | CYSLTR2CYSLTR1HTR2ASLC2A1CSNK1E | |
| Isopropylamine SCHEMBL1648067 | 0.74 | HTR2A (0.62) | SIGMAR1HTR2ALMNACHRM2CYP3A4 | |
| SCHEMBL11605622 | 0.73 | PPARG (0.60) | CYSLTR2CYSLTR1PPARGMEN1NR1I2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2017168431-A1 | PROCESS FOR THE PREPARATION OF SALMETEROL XINAFOATE | DAVULURI RAMAMOHAN RAO (IN) | 2017-10-05 | — | — | WO | disclosed |
| WO-2012032546-A2 | PROCESS FOR THE PREPARATION OF SALMETEROL AND ITS INTERMEDIATES | CADILA HEALTHCARE LIMITED (IN) | 2012-03-15 | — | — | WO | disclosed |