Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA2A | P08913 | 5/20 | 0.40 |
| ▸ | ADRA2B | P18089 | 5/20 | 0.40 |
| ▸ | ADRA2C | P18825 | 5/20 | 0.40 |
| ▸ | CYP19A1 | P11511 | 7/20 | 0.38 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.36 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.36 |
| ▸ | ADRA1A | P35348 | 4/20 | 0.36 |
| ▸ | ADRA1D | P25100 | 3/20 | 0.36 |
| ▸ | ADRA1B | P35368 | 3/20 | 0.36 |
| ▸ | CPA1 | P15085 | 1/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| SCHEMBL9783967 | 0.82 | CYP19A1 (0.50) | CYP19A1HRH4HRH3KCNH2 | |
| SCHEMBL9783400 | 0.81 | ADRA2A (0.48) | ADRA2AADRA2BADRA2CCYP19A1HRH4 | |
| SCHEMBL9783102 | 0.77 | LMNA (0.31) | — | |
| SCHEMBL9783986 | 0.75 | ADRA2A (0.50) | ADRA2AADRA2BADRA2CCYP19A1HRH4 | |
| Imidazole SCHEMBL9783730 | 0.74 | ALDH1A1 (0.36) | CYP19A1 | |
| SCHEMBL2626798 | 0.72 | CYP19A1 (0.52) | ADRA2AADRA2BADRA2CCYP19A1HRH4 | |
| SCHEMBL9783694 | 0.70 | CPA1 (0.41) | ADRA2AADRA2BADRA2CHRH4HRH3 | |
| SCHEMBL9783189 | 0.70 | HTR2A (0.33) | CYP19A1TP53 | |
| SCHEMBL9783057 | 0.69 | ADRA2A (0.37) | ADRA2AADRA2BADRA2CCYP19A1HRH4 | |
| SCHEMBL9783750 | 0.69 | CYP19A1 (0.54) | ADRA2AADRA2BADRA2CCYP19A1HRH3 |
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 |