Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRR1 | P24046 | 3/20 | 0.37 |
| ▸ | GABBR2 | O75899 | 1/20 | 0.37 |
| ▸ | GABBR1 | Q9UBS5 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.33 |
| ▸ | AOC3 | Q16853 | 3/20 | 0.32 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.31 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.31 |
| ▸ | DNM1 | Q05193 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL16384343 | 1.00 | GABRR1 (0.37) | GABRR1GABBR2GABBR1LMNAKDM4E | |
| SCHEMBL22893668 | 0.89 | KDM4E (0.36) | GABRR1GABBR2GABBR1LMNAKDM4E | |
| SCHEMBL22861312 | 0.85 | CHRM2 (0.42) | GABRR1GABBR2GABBR1LMNAKDM4E | |
| SCHEMBL22364057 | 0.85 | CHRM2 (0.37) | GABRR1GABBR2GABBR1LMNAKDM4E | |
| SCHEMBL29046394 | 0.83 | KDM4E (0.49) | GABRR1GABBR2GABBR1LMNAKDM4E | |
| SCHEMBL28966728 | 0.83 | KDM4E (0.49) | GABRR1GABBR2GABBR1LMNAKDM4E | |
| SCHEMBL22893631 | 0.83 | CHRM2 (0.46) | GABRR1GABBR2GABBR1LMNAKDM4E | |
| SCHEMBL22364054 | 0.83 | CHRM2 (0.46) | GABRR1GABBR2GABBR1LMNAKDM4E | |
| SCHEMBL22861404 | 0.83 | CHRM2 (0.41) | GABRR1GABBR2GABBR1LMNAKDM4E | |
| SCHEMBL689269 | 0.82 | — | — |
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-8933018-B2 | Boron containing polybasic bacterial efflux pump inhibitors and therapeutic uses thereof | REMPEX PHARMACEUTICALS, INC. (US) | 2015-01-13 | — | — | US | disclosed |