Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR1 | P32246 | 2/20 | 0.41 |
| ▸ | DRD2 | P14416 | 2/20 | 0.38 |
| ▸ | PIM1 | P11309 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | TMEM97 | Q5BJF2 | 2/20 | 0.36 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | CCR3 | P51677 | 1/20 | 0.36 |
| ▸ | AHR | P35869 | 1/20 | 0.35 |
| ▸ | HTR1A | P08908 | 1/20 | 0.35 |
| ▸ | HTR2A | P28223 | 1/20 | 0.35 |
| ▸ | HTR7 | P34969 | 1/20 | 0.35 |
| ▸ | HTR6 | P50406 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL7673324 | 0.94 | CCR1 (0.47) | CCR1DRD2SIGMAR1CYP2D6CCR3 | |
| SCHEMBL7678255 | 0.80 | SIGMAR1 (0.46) | CCR1SIGMAR1CYP2D6KEAP1SMN1; SMN2 | |
| SCHEMBL7681805 | 0.80 | HRH4 (0.45) | DRD2CYP2D6AHRHTR1AHTR2A | |
| Hydrochloric Acid SCHEMBL11400430 | 0.79 | HRH4 (0.44) | DRD2CYP2D6AHRHTR1AHTR2A | |
| SCHEMBL14299479 | 0.76 | GRIN1 (0.44) | — | |
| SCHEMBL7674579 | 0.74 | DRD2 (0.47) | CCR1DRD2CYP2D6SMN1; SMN2HTR1A | |
| SCHEMBL17771816 | 0.74 | NOTUM (0.44) | DRD2ALDH1A1SIGMAR1CYP2D6 | |
| SCHEMBL7245716 | 0.70 | CCR1 (0.54) | CCR1DRD2SIGMAR1CYP2D6CCR3 | |
| SCHEMBL7675250 | 0.70 | HTR2C (0.51) | DRD2PIM1ALDH1A1CYP2D6SMN1; SMN2 | |
| SCHEMBL17771811 | 0.70 | NOTUM (0.40) | CCR1DRD2ALDH1A1SIGMAR1CCR3 |
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 |
|---|---|---|---|---|---|---|---|
| US-6387893-B1 | ADRENERGIC BLOCKING AGENT; BENIGN PROSATATIC HYPERPLASIA | MERCK & CO., INC. | 2002-05-14 | — | — | US | disclosed |