Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD3 | P35462 | 2/20 | 0.43 |
| ▸ | DRD4 | P21917 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | HCRTR2 | O43614 | 3/20 | 0.32 |
| ▸ | GPR119 | Q8TDV5 | 3/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.31 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
| ▸ | SPR | P35270 | 2/20 | 0.31 |
| ▸ | EED | O75530 | 1/20 | 0.31 |
| ▸ | RBBP4 | Q09028 | 1/20 | 0.31 |
| ▸ | SUZ12 | Q15022 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL22018067 | 0.90 | DRD3 (0.42) | DRD3DRD4GPR119TSHRNR1H2 | |
| SCHEMBL22053355 | 0.83 | NTRK1 (0.36) | GPR119 | |
| SCHEMBL22053356 | 0.79 | DRD3 (0.48) | DRD3DRD4POLBGAAGPR119 | |
| SCHEMBL20691685 | 0.78 | MEN1 (0.39) | POLBGPR119HPGDKMT2AHSD17B10 | |
| SCHEMBL22615358 | 0.78 | MEN1 (0.39) | POLBGPR119HPGDKMT2AHSD17B10 | |
| SCHEMBL17936948 | 0.77 | SPR (0.36) | DRD3DRD4GPR119TSHRKMT2A | |
| SCHEMBL19632326 | 0.76 | GPR119 (0.38) | GPR119NR1H2KMT2ASPR | |
| SCHEMBL21058315 | 0.76 | GPR119 (0.38) | GPR119NR1H2KMT2ASPR | |
| SCHEMBL21260292 | 0.75 | GPR119 (0.37) | POLBGPR119SPR | |
| SCHEMBL21058322 | 0.74 | HDAC1 (0.38) | POLBGPR119TSHRSPR |
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-2019020070-A1 | PIPERAZINE HETEROARYL DERIVATIVE, PREPARATION METHOD THEREFOR AND USE OF SAME IN MEDICINE | 江苏恒瑞医药股份有限公司 | 2019-01-31 | — | — | WO | disclosed |