Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 2/20 | 0.40 |
| ▸ | HTR7 | P34969 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.31 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.30 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.30 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL7926933 | 0.86 | HTR1A (0.42) | HTR1AHTR7ALDH1A1HPGDKDM4E | |
| SCHEMBL7918188 | 0.86 | HTR1A (0.42) | HTR1AHTR7ALDH1A1HPGDKDM4E | |
| SCHEMBL7923504 | 0.84 | HTR1A (0.40) | HTR1AHTR7ALDH1A1HPGDKDM4E | |
| SCHEMBL7924305 | 0.84 | HTR1A (0.40) | HTR1AHTR7ALDH1A1HPGDKDM4E | |
| SCHEMBL7924617 | 0.80 | CYP11B1 (0.31) | — | |
| SCHEMBL12203500 | 0.78 | HTR1A (0.45) | HTR1AHTR7ALDH1A1HPGDKDM4E | |
| SCHEMBL7919413 | 0.78 | HTR1A (0.42) | HTR1AHTR7ALDH1A1HPGDKDM4E | |
| SCHEMBL7923650 | 0.78 | HTR1A (0.42) | HTR1AHTR7ALDH1A1HPGDKDM4E | |
| SCHEMBL15353804 | 0.76 | HTR1A (0.43) | HTR1AHTR7ALDH1A1HPGDKDM4E | |
| SCHEMBL14707566 | 0.75 | HTR1A (0.43) | HTR1AHTR7ALDH1A1HPGDKDM4E |
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-8476274-B2 | Biaryl spiroaminooxazoline analogues as Alpha2C adrenergic receptor modulators | MERCK SHARP & DOHME CORP. (US) | 2013-07-02 | — | — | US | disclosed |