Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB1 | P08588 | 3/20 | 0.46 |
| ▸ | DRD2 | P14416 | 2/20 | 0.46 |
| ▸ | DRD3 | P35462 | 2/20 | 0.46 |
| ▸ | HTR3A | P46098 | 4/20 | 0.40 |
| ▸ | HTR2C | P28335 | 4/20 | 0.40 |
| ▸ | HTR3E | A5X5Y0 | 2/20 | 0.40 |
| ▸ | HTR3B | O95264 | 2/20 | 0.40 |
| ▸ | HTR3D | Q70Z44 | 2/20 | 0.40 |
| ▸ | HTR3C | Q8WXA8 | 2/20 | 0.40 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | HTR1D | P28221 | 1/20 | 0.40 |
| ▸ | THRB | P10828 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | HTR1A | P08908 | 6/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.38 |
| ▸ | ADRB2 | P07550 | 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 | |
|---|---|---|---|---|
| SCHEMBL14060901 | 0.87 | ADRB1 (0.48) | ADRB1DRD2DRD3HTR3AHTR2C | |
| SCHEMBL27953737 | 0.81 | ADRB1 (0.49) | ADRB1DRD2DRD3HTR3AHTR2C | |
| SCHEMBL27774299 | 0.70 | ADRB1 (0.46) | ADRB1DRD2DRD3HTR3AHTR2C | |
| SCHEMBL4727692 | 0.70 | ADRB1 (0.64) | ADRB1DRD2DRD3HTR3AHTR2C | |
| Hydrochloric Acid SCHEMBL4725829 | 0.69 | ADRB1 (0.62) | ADRB1DRD2DRD3HTR3AHTR2C | |
| SCHEMBL27943377 | 0.68 | ADRB1 (0.51) | ADRB1DRD2DRD3HTR3AMAPT | |
| SCHEMBL233488 | 0.66 | ADRB2 (0.56) | ADRB1DRD2DRD3HTR3AHTR2C | |
| SCHEMBL230424 | 0.65 | ADRB1 (1.00) | ADRB1DRD2DRD3HTR3AHTR3E | |
| SCHEMBL29446047 | 0.65 | ADRB1 (1.00) | ADRB1DRD2DRD3HTR3AHTR3E | |
| SCHEMBL5785574 | 0.65 | ADRB1 (1.00) | ADRB1DRD2DRD3HTR3AHTR3E |
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 |
|---|---|---|---|---|---|---|---|
| CN-103703005-A | Tricyclic inhibitors of kinases | ABBOTT LAB | 2014-04-02 | — | — | CN | claimed |
| CN-103703005-A | Tricyclic inhibitors of kinases | ABBOTT LAB | 2014-04-02 | — | — | CN | disclosed |