Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | ATM | Q13315 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | DPP4 | P27487 | 4/20 | 0.42 |
| ▸ | CNR1 | P21554 | 4/20 | 0.41 |
| ▸ | CNR2 | P34972 | 2/20 | 0.41 |
| ▸ | DPP8 | Q6V1X1 | 3/20 | 0.41 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.39 |
| ▸ | CRHR1 | P34998 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | DRD2 | P14416 | 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 | |
|---|---|---|---|---|
| SCHEMBL3598377 | 0.99 | DPP4 (0.43) | HTTATMTDP1DPP4CNR1 | |
| SCHEMBL3601192 | 0.90 | TSHR (0.44) | HTTDPP4DPP8SIGMAR1KMT2A | |
| SCHEMBL3091767 | 0.82 | DPP4 (0.50) | DPP4CNR1DPP8CRHR1 | |
| SCHEMBL3600930 | 0.82 | DPP4 (0.46) | DPP4DPP8CRHR1CYP3A4 | |
| SCHEMBL3600855 | 0.81 | DPP4 (0.45) | DPP4DPP8CYP3A4 | |
| SCHEMBL3096850 | 0.80 | DPP4 (0.44) | DPP4DPP8CYP3A4 | |
| SCHEMBL3600802 | 0.80 | DPP4 (0.44) | DPP4CNR1DPP8 | |
| SCHEMBL3596892 | 0.80 | DPP4 (0.44) | DPP4DPP8CYP3A4 | |
| SCHEMBL3599695 | 0.79 | OPRL1 (0.46) | CNR1 | |
| SCHEMBL3596963 | 0.79 | DPP4 (0.58) | DPP4DPP8CYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| US-7728146-B2 | Enzyme inhibitors | PROBIODRUG AG (DE) | 2010-06-01 | — | — | US | claimed |