Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 2/20 | 0.40 |
| ▸ | GPR119 | Q8TDV5 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 3/20 | 0.38 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.37 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | CRHBP | P24387 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | CSNK1E | P49674 | 3/20 | 0.35 |
| ▸ | LIPG | Q9Y5X9 | 1/20 | 0.35 |
| ▸ | CKS1B | P61024 | 1/20 | 0.35 |
| ▸ | SKP1 | P63208 | 1/20 | 0.35 |
| ▸ | SKP2 | Q13309 | 1/20 | 0.35 |
| ▸ | EPHX2 | P34913 | 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 | |
|---|---|---|---|---|
| SCHEMBL27800645 | 0.84 | GPR119 (0.39) | HTTGPR119ALDH1A1MAPTNR1H2 | |
| SCHEMBL28785961 | 0.81 | RORC (0.38) | GPR119NR1H2CSNK1ELIPGSTS | |
| Trifluoroacetic Acid SCHEMBL27779974 | 0.77 | SMO (0.38) | ALDH1A1MAPTKDM4EHPGDTSHR | |
| SCHEMBL27800665 | 0.77 | GRIA1 (0.41) | NR1H2HDAC4MEN1KMT2ACSNK1E | |
| SCHEMBL25729734 | 0.76 | GPR119 (0.45) | HTTGPR119ALDH1A1MAPTNR1H2 | |
| Trifluoroacetic Acid SCHEMBL27779309 | 0.76 | DPP4 (0.36) | CSNK1E | |
| SCHEMBL13175269 | 0.75 | NR1H2 (0.44) | HTTGPR119ALDH1A1MAPTNR1H2 | |
| Hydrochloric Acid SCHEMBL27800778 | 0.73 | LIPG (0.38) | NR1H2LIPGSTS | |
| Trifluoroacetic Acid SCHEMBL27800718 | 0.73 | CYP1A2 (0.41) | MAPTNR1H2KDM4EHPGDTSHR | |
| SCHEMBL2855779 | 0.73 | NR1H2 (0.44) | HTTGPR119ALDH1A1MAPTNR1H2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-101641360-A | Piperazine derivatives, preparation method and medical application thereof | SHANGHAI HENGRUI PHARM CO LTD | 2010-02-03 | — | — | CN | disclosed |