Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.62 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.62 |
| ▸ | CYP3A4 | P08684 | 15/20 | 0.55 |
| ▸ | THRB | P10828 | 1/20 | 0.55 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | FYN | P06241 | 2/20 | 0.41 |
| ▸ | CYP51A1 | Q16850 | 2/20 | 0.41 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.41 |
| ▸ | PGR | P06401 | 1/20 | 0.41 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.41 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.41 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.41 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.41 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.41 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.41 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.41 |
| ▸ | DRD1 | P21728 | 1/20 | 0.41 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL9458028 | 0.91 | HSP90AA1 (0.63) | HSP90AA1NPSR1CYP3A4THRBLMNA | |
| SCHEMBL9458123 | 0.91 | CYP3A4 (0.67) | HSP90AA1NPSR1CYP3A4THRBLMNA | |
| SCHEMBL9457911 | 0.87 | CYP3A4 (0.62) | HSP90AA1NPSR1CYP3A4THRBLMNA | |
| Sulfuric Acid SCHEMBL9458148 | 0.85 | CYP3A4 (0.59) | HSP90AA1NPSR1CYP3A4THRBLMNA | |
| SCHEMBL1280576 | 0.84 | HSP90AA1 (0.58) | HSP90AA1NPSR1CYP3A4THRBLMNA | |
| SCHEMBL9458278 | 0.84 | HSP90AA1 (0.74) | HSP90AA1NPSR1CYP3A4THRBLMNA | |
| SCHEMBL10498749 | 0.84 | HSP90AA1 (0.62) | HSP90AA1NPSR1CYP3A4THRBLMNA | |
| SCHEMBL1280044 | 0.82 | HSP90AA1 (0.55) | HSP90AA1NPSR1CYP3A4THRBLMNA | |
| SCHEMBL1279519 | 0.82 | HSP90AA1 (0.55) | HSP90AA1NPSR1CYP3A4THRBLMNA | |
| SCHEMBL9458038 | 0.82 | HSP90AA1 (0.57) | HSP90AA1NPSR1CYP3A4THRBLMNA |
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-5266585-A | Controlling phytopathogenic microorganisms, fungicides, antimycotics, anticonvulsives and/or anxiolytic agents | CIBA-GEIGY CORPORATION (US) | 1993-11-30 | — | — | US | disclosed |