Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 2/20 | 0.49 |
| ▸ | NUDT1 | P36639 | 1/20 | 0.49 |
| ▸ | TAAR1 | Q96RJ0 | 7/20 | 0.45 |
| ▸ | HTR2A | P28223 | 3/20 | 0.45 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | HTR1A | P08908 | 1/20 | 0.45 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.45 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | HTR3A | P46098 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | SPHK1 | Q9NYA1 | 1/20 | 0.45 |
| ▸ | HTR1D | P28221 | 2/20 | 0.44 |
| ▸ | BLM | P54132 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL4363948 | 0.94 | BACE1 (0.56) | BACE1NUDT1TAAR1HTR2ACYP2A6 | |
| SCHEMBL14452295 | 0.91 | SPHK1 (0.51) | BACE1NUDT1TAAR1HTR2ACYP2A6 | |
| SCHEMBL11997346 | 0.83 | HRH3 (0.44) | SPHK1LOXL2 | |
| SCHEMBL28258215 | 0.82 | SLC18A3 (0.52) | BACE1TAAR1HTR2ACYP2A6CYP1A2 | |
| SCHEMBL3946982 | 0.81 | NUDT1 (0.38) | BACE1NUDT1TAAR1CYP2A6CYP1A2 | |
| SCHEMBL7926837 | 0.80 | GFER (0.54) | BACE1NUDT1ALDH1A1SPHK1HTR1D | |
| SCHEMBL28672856 | 0.80 | HTR3A (0.56) | HTR3A | |
| SCHEMBL19212128 | 0.80 | LSS (0.55) | TAAR1CYP2A6CYP1A2CYP2C19SPHK1 | |
| SCHEMBL16671443 | 0.79 | SPHK1 (0.57) | HTR2ASPHK1 | |
| SCHEMBL10232991 | 0.78 | HRH3 (0.44) | BACE1NUDT1SPHK1HTR1DLOXL2 |
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 |