Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.56 |
| ▸ | MC4R | P32245 | 2/20 | 0.50 |
| ▸ | MC5R | P33032 | 2/20 | 0.50 |
| ▸ | MC3R | P41968 | 1/20 | 0.50 |
| ▸ | KCNH3 | Q9ULD8 | 5/20 | 0.43 |
| ▸ | ROCK1 | Q13464 | 2/20 | 0.39 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.39 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.37 |
| ▸ | SCN8A | Q9UQD0 | 1/20 | 0.37 |
| ▸ | KAT2B | Q92831 | 1/20 | 0.37 |
| ▸ | MAOB | P27338 | 1/20 | 0.36 |
| ▸ | KCNQ2 | O43526 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.35 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.35 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 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 | |
|---|---|---|---|---|
| SCHEMBL10483895 | 0.93 | LOXL2 (0.59) | LOXL2MC4RMC5RMC3RKCNH3 | |
| SCHEMBL7981962 | 0.84 | LOXL2 (0.47) | LOXL2KCNH3ROCK1CHRM2SCN8A | |
| SCHEMBL10483909 | 0.81 | MC4R (0.50) | MC4RMC5RMC3RROCK1CHRM2 | |
| SCHEMBL10483879 | 0.81 | LOX (0.56) | LOXL2MC4RMC5RMC3RROCK1 | |
| SCHEMBL10636722 | 0.80 | MC4R (0.51) | MC4RMC5RMC3RCHRM2KAT2B | |
| SCHEMBL10734543 | 0.75 | ALDH1A1 (0.56) | LOXL2MC4RMC5RMC3RCHRM2 | |
| SCHEMBL10483999 | 0.75 | MC4R (0.47) | MC4RMC5RMC3RCHRM2SCN8A | |
| SCHEMBL18831147 | 0.75 | MC4R (0.44) | MC4RMC5RMC3RROCK1CHRM2 | |
| SCHEMBL21592231 | 0.75 | CYP19A1 (0.47) | TSHR | |
| SCHEMBL10483974 | 0.73 | LOX (0.59) | LOXL2MC4RMC5RMC3RROCK1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4812571-A | NITROMETHYLENE COMPOUNDS | NIHON TOKUSHU NOYAKU SEIZO K.K. (JP) | 1989-03-14 | — | — | US | disclosed |
| US-4774247-A | Nitromethylene derivative insecticides | NIHON TOKUSHU NOYAKU SEIZO K.K. (JP) | 1988-09-27 | — | — | US | disclosed |
| US-4678795-A | 1-pyridylmethyl-2-nitromethylene-1,3-diazacycloalkane insecticides | NIHON TOKUSHU NOYAKU SEIZO K.K. (JP) | 1987-07-07 | — | — | US | disclosed |
| EP-0163855-A1 | Nitromethylene derivatives, intermediates, and process for their preparation as insecticides | NIHON TOKUSHU NOYAKU SEIZO K.K. (JP) | 1985-12-11 | — | — | EP | disclosed |