Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTAFR | P25105 | 4/20 | 0.41 |
| ▸ | CYP11B2 | P19099 | 3/20 | 0.39 |
| ▸ | BRD4 | O60885 | 3/20 | 0.38 |
| ▸ | GABRA1 | P14867 | 9/20 | 0.38 |
| ▸ | GABRA5 | P31644 | 9/20 | 0.38 |
| ▸ | GABRA2 | P47869 | 9/20 | 0.38 |
| ▸ | GABRB2 | P47870 | 8/20 | 0.38 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.37 |
| ▸ | GABRA3 | P34903 | 6/20 | 0.37 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.37 |
| ▸ | HPGD | P15428 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | CNR1 | P21554 | 1/20 | 0.37 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.36 |
| ▸ | HTR2A | P28223 | 1/20 | 0.36 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.36 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.36 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL11394966 | 0.85 | PTAFR (0.41) | PTAFRCYP11B2BRD4GABRA1GABRA5 | |
| SCHEMBL11402978 | 0.85 | CYP11B2 (0.40) | PTAFRCYP11B2 | |
| SCHEMBL11401438 | 0.84 | BRD4 (0.53) | PTAFRBRD4GABRA1GABRA5GABRA2 | |
| SCHEMBL11393924 | 0.82 | CYP11B2 (0.31) | CYP11B2 | |
| SCHEMBL11397265 | 0.80 | BRD4 (0.51) | PTAFRBRD4GABRA1GABRA5GABRA2 | |
| SCHEMBL11401426 | 0.76 | CYP11B2 (0.36) | PTAFRCYP11B2GABRA5CYP11B1OPRK1 | |
| SCHEMBL13002467 | 0.72 | CYP11B2 (0.41) | PTAFRCYP11B2BRD4GABRA1GABRA5 | |
| SCHEMBL13285201 | 0.71 | GABRA5 (0.63) | PTAFRBRD4GABRA1GABRA5GABRA2 | |
| SCHEMBL11400552 | 0.71 | PTAFR (0.48) | PTAFRCYP11B2BRD4GABRA1GABRA5 | |
| SCHEMBL11397276 | 0.70 | GABRA1 (0.53) | PTAFRCYP11B2BRD4GABRA1GABRA5 |
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 |
|---|---|---|---|---|---|---|---|
| US-4296239-A | Amino-4H-s-triazolo[4,3-a][1,4]benzodiazepines | THE UPJOHN COMPANY (US) | 1981-10-20 | — | — | US | disclosed |
| US-4180668-A | Piperidino-4H-s-triazolo[4,3-a][1,4]benzodiazepines | THE UPJOHN COMPANY (US) | 1979-12-25 | — | — | US | disclosed |