Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRA1 | P14867 | 3/20 | 0.53 |
| ▸ | GABRA5 | P31644 | 3/20 | 0.53 |
| ▸ | GABRA3 | P34903 | 3/20 | 0.53 |
| ▸ | GABRA2 | P47869 | 3/20 | 0.53 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.53 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.53 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.53 |
| ▸ | HTR2A | P28223 | 1/20 | 0.53 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.53 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.53 |
| ▸ | PTAFR | P25105 | 10/20 | 0.51 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.51 |
| ▸ | TSHR | P16473 | 1/20 | 0.51 |
| ▸ | BRD4 | O60885 | 1/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL11076110 | 0.88 | PTAFR (0.51) | GABRA1GABRA5GABRA3GABRA2GABRG2 | |
| SCHEMBL11076943 | 0.87 | BRD4 (0.52) | GABRA1GABRA5GABRA3GABRA2OPRK1 | |
| SCHEMBL11507032 | 0.85 | OPRK1 (0.57) | OPRK1PDE4DPTAFRCYP3A4ALOX15 | |
| SCHEMBL8928526 | 0.84 | OPRK1 (0.71) | OPRK1PDE4DPTAFRCYP3A4ALOX15 | |
| SCHEMBL7327273 | 0.80 | OPRK1 (0.66) | GABRA1GABRA5GABRA3GABRA2OPRK1 | |
| SCHEMBL10404914 | 0.80 | GABRA1 (0.48) | GABRA1GABRA5GABRA3GABRA2OPRK1 | |
| SCHEMBL8274469 | 0.78 | GABRA1 (0.80) | GABRA1GABRA5GABRA3GABRA2OPRK1 | |
| SCHEMBL11689392 | 0.78 | GABRA1 (0.51) | GABRA1GABRA5GABRA3GABRA2OPRK1 | |
| SCHEMBL11757853 | 0.77 | GABRA1 (0.64) | GABRA1GABRA5GABRA3GABRA2OPRK1 | |
| Propionic Acid SCHEMBL10404916 | 0.77 | GABRA1 (0.50) | GABRA1GABRA5GABRA3GABRA2OPRK1 |
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-4427590-A | Triazolobenzodiazepine derivatives | CIBA-GEIGY CORPORATION (US) | 1984-01-24 | — | — | US | disclosed |