Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B1 | P15538 | 5/20 | 0.35 |
| ▸ | CYP11B2 | P19099 | 5/20 | 0.35 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.35 |
| ▸ | IDO1 | P14902 | 1/20 | 0.33 |
| ▸ | QPCT | Q16769 | 6/20 | 0.32 |
| ▸ | GSK3B | P49841 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL9784074 | 0.80 | HSP90AA1 (0.33) | CYP11B1CYP11B2IDO1 | |
| SCHEMBL9784052 | 0.75 | CYP11B1 (0.45) | CYP11B1CYP11B2CYP19A1QPCT | |
| SCHEMBL9783391 | 0.74 | GPBAR1 (0.31) | — | |
| SCHEMBL9783872 | 0.71 | ALDH1A1 (0.46) | CYP19A1IDO1 | |
| SCHEMBL9783620 | 0.69 | CYP11B1 (0.42) | CYP11B1CYP11B2IDO1 | |
| SCHEMBL9783916 | 0.69 | CYP11B1 (0.41) | CYP11B1CYP11B2IDO1 | |
| SCHEMBL6496747 | 0.67 | CYP11B1 (0.63) | CYP11B1CYP11B2CYP19A1IDO1QPCT | |
| SCHEMBL9783749 | 0.67 | ALDH1A1 (0.31) | — | |
| SCHEMBL9783896 | 0.66 | TBXAS1 (0.39) | CYP11B1CYP11B2 | |
| SCHEMBL9784114 | 0.66 | TBXAS1 (0.55) | CYP19A1TSHR |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5051514-A | Complexing boranes and imidazoles | CHEVRON RESEARCH AND TECHNOLOGY COMPANY (US) | 1991-09-24 | — | — | US | disclosed |
| EP-0432987-A2 | Fungicidal organoborane imidazole compounds and intermediates therefor | CHEVRON RESEARCH AND TECHNOLOGY COMPANY (US) | 1991-06-19 | — | — | EP | disclosed |
| US-4983589-A | Fungicidal imidazole diphenylaliphaticboranes and derivatives thereof | CHEVRON RESEARCH AND TECHNOLOGY COMPANY (US) | 1991-01-08 | — | — | US | disclosed |