Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.44 |
| ▸ | STAT3 | P40763 | 1/20 | 0.42 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | UTS2R | Q9UKP6 | 5/20 | 0.38 |
| ▸ | IDO1 | P14902 | 1/20 | 0.37 |
| ▸ | TDO2 | P48775 | 1/20 | 0.37 |
| ▸ | IDO2 | Q6ZQW0 | 1/20 | 0.37 |
| ▸ | JAK2 | O60674 | 1/20 | 0.37 |
| ▸ | JAK1 | P23458 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL903888 | 1.00 | ALDH1A1 (0.44) | ALDH1A1KDM4ESTAT3GPR119CYP1A2 | |
| SCHEMBL903880 | 0.90 | KDM4E (0.42) | ALDH1A1KDM4EGPR119UTS2R | |
| SCHEMBL903894 | 0.90 | GPR119 (0.49) | ALDH1A1KDM4EGPR119NR1H2POLB | |
| SCHEMBL903892 | 0.83 | GPR119 (0.48) | ALDH1A1KDM4EGPR119NR1H2POLB | |
| SCHEMBL904081 | 0.77 | KDM4E (0.42) | ALDH1A1KDM4ESTAT3GPR119UTS2R | |
| SCHEMBL12239153 | 0.74 | GPR119 (0.60) | ALDH1A1KDM4EGPR119 | |
| SCHEMBL31203073 | 0.74 | ALDH1A1 (0.46) | ALDH1A1GPR119NR1H2LMNA | |
| SCHEMBL3596539 | 0.72 | FAAH (0.56) | — | |
| SCHEMBL10190043 | 0.72 | UTS2R (0.44) | UTS2RIDO1TDO2IDO2 | |
| SCHEMBL322856 | 0.71 | PDE4B (0.45) | KDM4EUTS2R |
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-2012041158-A1 | TRICYCLIC COMPOUND, PREPARATION METHOD AND PHARMACEUTICAL USE THEREOF | 上海恒瑞医药有限公司 (CN) | 2012-04-05 | — | — | WO | disclosed |