Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DPP4 | P27487 | 2/20 | 0.36 |
| ▸ | DPP8 | Q6V1X1 | 1/20 | 0.36 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.35 |
| ▸ | CSNK1D | P48730 | 4/20 | 0.35 |
| ▸ | CSNK1E | P49674 | 4/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.34 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.34 |
| ▸ | P2RX7 | Q99572 | 4/20 | 0.34 |
| ▸ | WNT1 | P04628 | 1/20 | 0.32 |
| ▸ | GSK3B | P49841 | 1/20 | 0.32 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.32 |
| ▸ | HMGCR | P04035 | 1/20 | 0.32 |
| ▸ | SMO | Q99835 | 1/20 | 0.32 |
| ▸ | HTR2A | P28223 | 1/20 | 0.32 |
| ▸ | HTR2C | P28335 | 1/20 | 0.32 |
| ▸ | HTR2B | P41595 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| Trifluoroacetic Acid SCHEMBL27779335 | 0.91 | TGFBR1 (0.40) | TGFBR1CSNK1DCSNK1EWNT1GSK3B | |
| Trifluoroacetic Acid SCHEMBL27779974 | 0.83 | SMO (0.38) | DPP4CSNK1DCSNK1EP2RX7SMO | |
| Trifluoroacetic Acid SCHEMBL27861538 | 0.80 | GPR6 (0.36) | CSNK1DCSNK1ESMO | |
| Trifluoroacetic Acid SCHEMBL27779373 | 0.79 | DPP4 (0.33) | DPP4 | |
| Hydrochloric Acid SCHEMBL27800611 | 0.78 | P2RX7 (0.31) | P2RX7 | |
| Trifluoroacetic Acid SCHEMBL27779686 | 0.77 | DPP4 (0.32) | DPP4 | |
| SCHEMBL27779322 | 0.76 | HTT (0.40) | CSNK1E | |
| SCHEMBL27800665 | 0.75 | GRIA1 (0.41) | TGFBR1CSNK1DCSNK1EKCNH2PDK2 | |
| SCHEMBL27779351 | 0.73 | KCNH2 (0.34) | TGFBR1KCNH2 | |
| Trifluoroacetic Acid SCHEMBL27779225 | 0.70 | PKM (0.33) | HTR2AHTR2C |
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 |