Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 5/20 | 0.66 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.62 |
| ▸ | GPR84 | Q9NQS5 | 2/20 | 0.47 |
| ▸ | ESR1 | P03372 | 2/20 | 0.47 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.47 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.47 |
| ▸ | TACR2 | P21452 | 2/20 | 0.47 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.47 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.47 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | SHBG | P04278 | 1/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | HSPD1 | P10809 | 1/20 | 0.47 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.47 |
| ▸ | HTR2C | P28335 | 1/20 | 0.47 |
| ▸ | HSPE1 | P61604 | 1/20 | 0.47 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL8967024 | 0.83 | GPR84 (0.47) | PTGS2CYP3A4GPR84ALDH1A1HSD17B10 | |
| SCHEMBL7937910 | 0.83 | GPR84 (0.52) | PTGS2CYP3A4GPR84ALDH1A1HSD17B10 | |
| SCHEMBL4444098 | 0.80 | PTGS2 (1.00) | PTGS2CYP3A4ESR1ADRA2AADORA3 | |
| SCHEMBL68692 | 0.80 | PTGS2 (1.00) | PTGS2CYP3A4ESR1ADRA2AADORA3 | |
| SCHEMBL70443 | 0.80 | PTGS2 (1.00) | PTGS2CYP3A4ESR1ADRA2AADORA3 | |
| SCHEMBL11782606 | 0.80 | PTGS2 (0.91) | PTGS2CYP3A4GPR84ESR1ADRA2A | |
| SCHEMBL11737365 | 0.80 | PTGS2 (1.00) | PTGS2CYP3A4ESR1ADRA2AADORA3 | |
| SCHEMBL6536156 | 0.80 | PTGS2 (0.91) | PTGS2CYP3A4GPR84ESR1ADRA2A | |
| SCHEMBL70292 | 0.80 | PTGS2 (1.00) | PTGS2CYP3A4ESR1ADRA2AADORA3 | |
| SCHEMBL4971459 | 0.80 | PTGS2 (0.91) | PTGS2CYP3A4GPR84ESR1ADRA2A |
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-4251545-A | Fungicidal process using 1-(alkoxyaroyl)guanidines | GAF CORPORATION (US) | 1981-02-17 | — | — | US | disclosed |