Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA2A | P08913 | 2/20 | 0.51 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.51 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.46 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.46 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.46 |
| ▸ | CA12 | O43570 | 1/20 | 0.44 |
| ▸ | CA1 | P00915 | 1/20 | 0.44 |
| ▸ | CA2 | P00918 | 1/20 | 0.44 |
| ▸ | CA7 | P43166 | 1/20 | 0.44 |
| ▸ | CA9 | Q16790 | 1/20 | 0.44 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.44 |
| ▸ | APLNR | P35414 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | BLM | P54132 | 1/20 | 0.42 |
| ▸ | BCHE | P06276 | 1/20 | 0.41 |
| ▸ | TYR | P14679 | 1/20 | 0.41 |
| ▸ | ACHE | P22303 | 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 | |
|---|---|---|---|---|
| SCHEMBL13493018 | 0.85 | ADRA2A (0.53) | ADRA2AADRA1AADRB2ADRB1ADRB3 | |
| SCHEMBL9417826 | 0.85 | ADRA2A (0.53) | ADRA2AADRA1AADRB2ADRB1ADRB3 | |
| SCHEMBL9082001 | 0.84 | ADRA2A (0.51) | ADRA2AADRA1AADRB2ADRB1ADRB3 | |
| SCHEMBL2975604 | 0.83 | ADRA1A (0.57) | ADRA2AADRA1AADRB2ADRB1ADRB3 | |
| SCHEMBL29684720 | 0.83 | ADRA1A (0.57) | ADRA2AADRA1AADRB2ADRB1ADRB3 | |
| SCHEMBL7153263 | 0.81 | ADRA1A (0.75) | ADRA2AADRA1AADRB2ADRB1ADRB3 | |
| SCHEMBL9173075 | 0.81 | ADRA2A (0.56) | ADRA2AADRA1AADRB2ADRB1ADRB3 | |
| SCHEMBL8537740 | 0.80 | ADRA2A (0.48) | ADRA2AADRA1AADRB2ADRB1ADRB3 | |
| SCHEMBL3916474 | 0.80 | RAB9A (0.44) | ADRA2AADRA1ACA12CA1CA2 | |
| SCHEMBL3916470 | 0.80 | RAB9A (0.44) | ADRA2AADRA1ACA12CA1CA2 |
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-3013832-B1 | PYRAZOLE COMPOUNDS AS MODULATORS OF FSHR AND USES THEREOF | MERCK PATENT GMBH (DE) | 2020-11-04 | — | — | EP | disclosed |