Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB1 | P08588 | 1/20 | 0.51 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.47 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.47 |
| ▸ | RBP4 | P02753 | 1/20 | 0.46 |
| ▸ | HTR2C | P28335 | 5/20 | 0.45 |
| ▸ | HTR2A | P28223 | 4/20 | 0.45 |
| ▸ | HTR2B | P41595 | 4/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | OGA | O60502 | 1/20 | 0.44 |
| ▸ | PKM | P14618 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | SLC6A7 | Q99884 | 1/20 | 0.42 |
| ▸ | NR1H3 | Q13133 | 3/20 | 0.41 |
| ▸ | NR1H2 | P55055 | 2/20 | 0.41 |
| ▸ | GPBAR1 | Q8TDU6 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | ACACB | O00763 | 1/20 | 0.41 |
| ▸ | PARP1 | P09874 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL17538377 | 1.00 | ADRB1 (0.51) | ADRB1CHRM2CHRM3RBP4HTR2C | |
| SCHEMBL12153215 | 0.88 | ADRB1 (0.47) | ADRB1CHRM2CHRM3RBP4HTR2C | |
| SCHEMBL13677241 | 0.83 | ADRB1 (0.55) | ADRB1CHRM2CHRM3RBP4HTR2C | |
| SCHEMBL13677250 | 0.83 | ADRB1 (0.55) | ADRB1CHRM2CHRM3RBP4HTR2C | |
| SCHEMBL12153149 | 0.80 | ADRB1 (0.51) | ADRB1CHRM2CHRM3RBP4HTR2C | |
| SCHEMBL13676971 | 0.80 | ADRB1 (0.51) | ADRB1CHRM2CHRM3RBP4HTR2C | |
| SCHEMBL19035671 | 0.78 | GRM1 (0.46) | KDM4ESLC6A7 | |
| SCHEMBL8354208 | 0.78 | ADRB1 (0.78) | ADRB1RBP4HTR2CHTR2AHTR2B | |
| SCHEMBL13059864 | 0.76 | ADRB1 (0.55) | ADRB1RBP4HTR2CHTR2AHTR2B | |
| SCHEMBL1735009 | 0.75 | ADRB1 (0.66) | ADRB1RBP4HTR2CHTR2AHTR2B |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1954287-B2 | CETP INHIBITORS | MERCK SHARP & DOHME (US) | 2016-02-24 | — | — | EP | disclosed |