Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MC4R | P32245 | 1/20 | 0.36 |
| ▸ | MC5R | P33032 | 1/20 | 0.36 |
| ▸ | MC3R | P41968 | 1/20 | 0.36 |
| ▸ | CNR1 | P21554 | 1/20 | 0.34 |
| ▸ | CNR2 | P34972 | 1/20 | 0.34 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | CHRNB2 | P17787 | 2/20 | 0.32 |
| ▸ | CHRNB4 | P30926 | 2/20 | 0.32 |
| ▸ | CHRNA3 | P32297 | 2/20 | 0.32 |
| ▸ | CHRNA4 | P43681 | 2/20 | 0.32 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.32 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.32 |
| ▸ | S1PR2 | O95136 | 2/20 | 0.32 |
| ▸ | S1PR1 | P21453 | 2/20 | 0.32 |
| ▸ | S1PR3 | Q99500 | 2/20 | 0.32 |
| ▸ | LPAR2 | Q9HBW0 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL16264583 | 0.93 | CYP3A4 (0.42) | MC4RMC5RMC3RCNR1CNR2 | |
| Hydrochloric Acid SCHEMBL29778321 | 0.92 | CYP3A4 (0.41) | MC4RMC5RMC3RCNR1CNR2 | |
| SCHEMBL19696563 | 0.87 | MC4R (0.37) | MC4RMC5RMC3RCNR1CNR2 | |
| SCHEMBL16264600 | 0.86 | MC4R (0.40) | MC4RMC5RMC3RCNR1CNR2 | |
| Hydrochloric Acid SCHEMBL29778307 | 0.85 | MC4R (0.40) | MC4RMC5RMC3RCNR1CNR2 | |
| SCHEMBL16264579 | 0.82 | CNR1 (0.44) | MC4RMC5RMC3RCNR1CNR2 | |
| Hydrochloric Acid SCHEMBL29778341 | 0.81 | CNR1 (0.44) | MC4RMC5RMC3RCNR1CNR2 | |
| SCHEMBL18223035 | 0.78 | CYP3A4 (0.39) | CYP3A4CHRNB2CHRNB4CHRNA3CHRNA4 | |
| SCHEMBL16151765 | 0.77 | MC4R (0.47) | MC4RMC5RMC3RKMT2AHRH4 | |
| SCHEMBL18223037 | 0.74 | CYP3A4 (0.40) | CYP3A4 |
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-9839219-B2 | Compositions comprising a biocidal polyamine | CURZA GLOBAL, LLC (US) | 2017-12-12 | — | — | US | disclosed |