Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 9/20 | 0.53 |
| ▸ | MAOB | P27338 | 4/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.44 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.44 |
| ▸ | HTR2A | P28223 | 3/20 | 0.43 |
| ▸ | BACE1 | P56817 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | HTR1A | P08908 | 1/20 | 0.39 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | HTR3A | P46098 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | BLM | P54132 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | F2 | P00734 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL994398 | 0.81 | MAPT (0.43) | MAOBALDH1A1L3MBTL1KMT2ATDP1 | |
| SCHEMBL3942362 | 0.78 | TAAR1 (0.52) | TAAR1MAOBCYP1A2CYP2A6HTR2A | |
| Hydrochloric Acid SCHEMBL3943536 | 0.76 | TAAR1 (0.50) | TAAR1MAOBCYP1A2CYP2A6HTR2A | |
| SCHEMBL1141384 | 0.73 | CA1 (0.34) | MAOBCYP2A6ALDH1A1KMT2A | |
| SCHEMBL8445728 | 0.73 | CCR1 (0.43) | CYP2A6HTR2AL3MBTL1KMT2ATSHR | |
| SCHEMBL10389822 | 0.73 | ESR1 (0.54) | SLC6A2TSHR | |
| SCHEMBL307300 | 0.73 | KIF11 (0.48) | CYP2A6ALDH1A1TSHRLOXL2 | |
| SCHEMBL13271382 | 0.72 | CYP2D6 (0.44) | TAAR1ALDH1A1CYP2C19CYP2D6TSHR | |
| SCHEMBL306876 | 0.71 | PDE2A (0.49) | — | |
| SCHEMBL1756296 | 0.71 | CASP1 (0.34) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2051967-A1 | BENZIMIDAZOLE DERIVATIVES USEFUL IN TREATMENT OF VALLINOID RECEPTOR TRPV1 RELATED DISORDERS | AstraZeneca AB (SE) | 2009-04-29 | — | — | EP | disclosed |
| WO-2008018827-A1 | BENZIMIDAZOLE DERIVATIVES USEFUL IN TREATMENT OF VALLINOID RECEPTOR TRPV1 RELATED DISORDERS | ASTRAZENECA AB (SE) | 2008-02-14 | — | — | WO | disclosed |