Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM1A | O60341 | 13/20 | 0.57 |
| ▸ | HTR1A | P08908 | 4/20 | 0.50 |
| ▸ | HTR7 | P34969 | 3/20 | 0.50 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.49 |
| ▸ | ABCB11 | O95342 | 2/20 | 0.48 |
| ▸ | LMNA | P02545 | 2/20 | 0.48 |
| ▸ | TP53 | P04637 | 2/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.48 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.48 |
| ▸ | MAPT | P10636 | 2/20 | 0.48 |
| ▸ | DRD2 | P14416 | 2/20 | 0.48 |
| ▸ | TSHR | P16473 | 2/20 | 0.48 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.48 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.48 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.48 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.48 |
| ▸ | HTR2A | P28223 | 2/20 | 0.48 |
| ▸ | HTR2C | P28335 | 2/20 | 0.48 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL5808304 | 0.99 | KDM1A (0.56) | KDM1AHTR1AHTR7SIGMAR1ABCB11 | |
| SCHEMBL5809382 | 0.91 | KDM1A (0.50) | KDM1AHTR1AHTR7SIGMAR1ABCB11 | |
| Hydrochloric Acid SCHEMBL5809446 | 0.90 | KDM1A (0.49) | KDM1AHTR1AHTR7SIGMAR1ABCB11 | |
| SCHEMBL5821135 | 0.89 | KDM1A (0.46) | KDM1AHTR1AHTR7ABCB11LMNA | |
| Hydrochloric Acid SCHEMBL5816094 | 0.88 | KDM1A (0.45) | KDM1AHTR1AHTR7ABCB11LMNA | |
| SCHEMBL5804945 | 0.82 | KDM1A (0.67) | KDM1AHTR1AHTR7CYP1A2CYP3A4 | |
| SCHEMBL4522960 | 0.82 | HTR1A (0.61) | HTR1AHTR7CYP1A2DRD2CYP2C19 | |
| Hydrochloric Acid SCHEMBL5808276 | 0.81 | KDM1A (0.66) | KDM1AHTR1AHTR7CYP1A2CYP3A4 | |
| Hydrochloric Acid SCHEMBL4524619 | 0.81 | HTR1A (0.60) | HTR1AHTR7CYP1A2DRD2CYP2C19 | |
| SCHEMBL5424281 | 0.81 | HTR1A (0.56) | HTR1AHTR7CYP1A2CYP3A4CYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2006117760-A1 | ADRENERGIC RECEPTOR ANTAGONISTS | RANBAXY LABORATORIES LIMITED (IN) | 2006-11-09 | — | — | WO | claimed |