Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 3/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | USP2 | O75604 | 1/20 | 0.44 |
| ▸ | MMP9 | P14780 | 1/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.44 |
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
| ▸ | CA9 | Q16790 | 1/20 | 0.38 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.36 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.36 |
| ▸ | PPARA | Q07869 | 2/20 | 0.36 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.34 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL3593821 | 0.90 | TAAR1 (0.50) | TAAR1TSHRALDH1A1LMNAKDM4E | |
| SCHEMBL5643020 | 0.80 | TAAR1 (0.44) | TAAR1TSHRALDH1A1KDM4ECA1 | |
| SCHEMBL11039745 | 0.77 | KDM4E (0.43) | TAAR1TSHRALDH1A1LMNAKDM4E | |
| SCHEMBL2453322 | 0.76 | ALDH1A1 (0.50) | TAAR1TSHRALDH1A1LMNAKDM4E | |
| SCHEMBL5761353 | 0.74 | TAAR1 (0.47) | TAAR1TSHRALDH1A1LMNAKDM4E | |
| SCHEMBL14286922 | 0.73 | TAAR1 (0.50) | TAAR1TSHRALDH1A1KDM4ENR3C1 | |
| SCHEMBL17679924 | 0.73 | TAAR1 (0.50) | TAAR1TSHRALDH1A1LMNAKDM4E | |
| SCHEMBL4700507 | 0.73 | TAAR1 (0.50) | TAAR1TSHRALDH1A1KDM4ENR3C1 | |
| SCHEMBL10173843 | 0.73 | TAAR1 (0.50) | TAAR1TSHRPPARAPOLBTDP1 | |
| SCHEMBL1610116 | 0.73 | TAAR1 (0.59) | TAAR1TSHRALDH1A1KDM4ENR3C1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2016046782-A1 | IMIDAZOLE BIARYL COMPOUNDS AS S-NITROSOGLUTATHIONE REDUCTASE INHIBITORS | GLENMARK PHARMACEUTICALS S.A. (CH) | 2016-03-31 | — | — | WO | disclosed |