Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | STAT3 | P40763 | 1/20 | 0.41 |
| ▸ | UTS2R | Q9UKP6 | 5/20 | 0.38 |
| ▸ | GPR119 | Q8TDV5 | 4/20 | 0.38 |
| ▸ | HTT | P42858 | 2/20 | 0.37 |
| ▸ | HDAC3 | O15379 | 3/20 | 0.36 |
| ▸ | HDAC4 | P56524 | 3/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.36 |
| ▸ | HDAC7 | Q8WUI4 | 3/20 | 0.36 |
| ▸ | HDAC2 | Q92769 | 3/20 | 0.36 |
| ▸ | HDAC10 | Q969S8 | 3/20 | 0.36 |
| ▸ | HDAC11 | Q96DB2 | 3/20 | 0.36 |
| ▸ | HDAC8 | Q9BY41 | 3/20 | 0.36 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.36 |
| ▸ | HDAC9 | Q9UKV0 | 3/20 | 0.36 |
| ▸ | HDAC5 | Q9UQL6 | 3/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL904081 | 0.94 | KDM4E (0.42) | KDM4EALDH1A1STAT3UTS2RGPR119 | |
| SCHEMBL904096 | 0.84 | NPC1 (0.40) | KDM4EALDH1A1UTS2RGPR119TSHR | |
| SCHEMBL1006695 | 0.83 | GPR119 (0.47) | KDM4EALDH1A1STAT3UTS2RGPR119 | |
| SCHEMBL13660399 | 0.77 | UTS2R (0.43) | UTS2RGPR119HTT | |
| SCHEMBL10067573 | 0.76 | KDM4E (0.42) | KDM4EGPR119 | |
| SCHEMBL1005645 | 0.75 | GPR119 (0.45) | KDM4EGPR119 | |
| SCHEMBL1006128 | 0.74 | GPR119 (0.47) | KDM4EGPR119 | |
| SCHEMBL1008624 | 0.73 | GPR119 (0.47) | KDM4EUTS2RGPR119 | |
| SCHEMBL1004810 | 0.73 | GPR119 (0.48) | KDM4EGPR119KCNH2 | |
| SCHEMBL1006217 | 0.73 | GPR119 (0.47) | KDM4EALDH1A1GPR119LMNA |
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 |