Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB1 | P08588 | 6/20 | 0.35 |
| ▸ | HTR3E | A5X5Y0 | 2/20 | 0.35 |
| ▸ | HTR3B | O95264 | 2/20 | 0.35 |
| ▸ | HTR3A | P46098 | 2/20 | 0.35 |
| ▸ | HTR3D | Q70Z44 | 2/20 | 0.35 |
| ▸ | HTR3C | Q8WXA8 | 2/20 | 0.35 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | ADRB2 | P07550 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | BPTF | Q12830 | 1/20 | 0.33 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.33 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.33 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.33 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.33 |
| ▸ | NCF1 | P14598 | 1/20 | 0.33 |
| ▸ | PLD1 | Q13393 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | HRH1 | P35367 | 1/20 | 0.31 |
| ▸ | CASP1 | P29466 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL18052759 | 0.69 | ADRB1 (0.41) | ADRB1HTR3EHTR3BHTR3AHTR3D | |
| SCHEMBL13650809 | 0.67 | ALDH1A1 (0.38) | ADRB1HTR3EHTR3BHTR3AHTR3D | |
| SCHEMBL13580121 | 0.67 | ADRB1 (0.36) | ADRB1HTR3EHTR3BHTR3AHTR3D | |
| SCHEMBL28480893 | 0.65 | ADRB1 (0.35) | ADRB1HTR3EHTR3BHTR3AHTR3D | |
| SCHEMBL4703910 | 0.65 | ADRB1 (0.35) | ADRB1HTR3EHTR3BHTR3AHTR3D | |
| SCHEMBL10273036 | 0.65 | — | — | |
| SCHEMBL27598894 | 0.64 | HTR3E (0.39) | ADRB1HTR3EHTR3BHTR3AHTR3D | |
| SCHEMBL27907809 | 0.64 | ADRB1 (0.38) | ADRB1HTR3EHTR3BHTR3AHTR3D | |
| SCHEMBL28705412 | 0.63 | ADRB1 (0.35) | ADRB1HTR3EHTR3BHTR3AHTR3D | |
| SCHEMBL16619199 | 0.59 | KDM4E (0.38) | ADRB1HTR3EHTR3BHTR3AHTR3D |
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 |
|---|---|---|---|---|---|---|---|
| CN-104955807-A | Positive allosteric modulators of mGluR3 | MERCK PATENT GMBH | 2015-09-30 | — | — | CN | disclosed |