Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRA1 | P14867 | 2/20 | 0.35 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 3/20 | 0.33 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.32 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 3/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.31 |
| ▸ | FAAH | O00519 | 1/20 | 0.31 |
| ▸ | CA1 | P00915 | 1/20 | 0.31 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.31 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.31 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.31 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.31 |
| ▸ | HTR2C | P28335 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL13068680 | 0.86 | IDO1 (0.36) | ALDH1A1CYP3A4CYP1A2CYP2C9ALOX15 | |
| SCHEMBL14473089 | 0.86 | IDO1 (0.36) | ALDH1A1CYP3A4CYP1A2CYP2C9ALOX15 | |
| SCHEMBL17308515 | 0.76 | LMNA (0.52) | LMNAKDM4ECYP3A4CYP1A2HPGD | |
| SCHEMBL17787353 | 0.76 | TSHR (0.50) | TSHR | |
| SCHEMBL15702876 | 0.76 | LMNA (0.52) | LMNAKDM4ECYP3A4CYP1A2HPGD | |
| SCHEMBL17624696 | 0.74 | ALDH1A1 (0.36) | ALDH1A1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL5613958 | 0.74 | GABRA1 (0.50) | GABRA1GABRB2LMNAHIF1ATSHR | |
| SCHEMBL13760578 | 0.74 | TRPA1 (0.30) | — | |
| SCHEMBL14472956 | 0.74 | CYP2C19 (0.47) | ALDH1A1CYP3A4CYP2C9ALOX15CYP2C19 | |
| SCHEMBL24265123 | 0.70 | GABRA1 (0.36) | GABRA1GABRB2LMNAHIF1ATSHR |
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 |
|---|---|---|---|---|---|---|---|
| EP-1966188-B1 | ENANTIOSELECTIVE PREPARATION OF BENZIMIDAZOLE DERIVATIVES AND THEIR SALTS | RATIOPHARM GMBH (DE) | 2010-11-03 | — | — | EP | disclosed |