Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DPP4 | P27487 | 1/20 | 0.41 |
| ▸ | GOT1 | P17174 | 1/20 | 0.41 |
| ▸ | HTR2A | P28223 | 3/20 | 0.41 |
| ▸ | MPO | P05164 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.41 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.41 |
| ▸ | HTR1D | P28221 | 1/20 | 0.41 |
| ▸ | HTR1B | P28222 | 1/20 | 0.41 |
| ▸ | HTR2C | P28335 | 1/20 | 0.41 |
| ▸ | HTR7 | P34969 | 1/20 | 0.41 |
| ▸ | CTSK | P43235 | 1/20 | 0.41 |
| ▸ | HTR6 | P50406 | 1/20 | 0.41 |
| ▸ | CYP2A13 | Q16696 | 1/20 | 0.41 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.41 |
| ▸ | CDK4 | P11802 | 2/20 | 0.41 |
| ▸ | CCND1 | P24385 | 2/20 | 0.41 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL3595401 | 0.88 | HTR2A (0.46) | DPP4HTR2AMPOCDK4CCND1 | |
| SCHEMBL3088301 | 0.88 | HTR2A (0.46) | DPP4HTR2AHTR1DCDK4CCND1 | |
| SCHEMBL3605880 | 0.85 | MDM4 (0.43) | GOT1HTR2AHTR1DHTR1BHTR2C | |
| SCHEMBL3596995 | 0.83 | SLC6A4 (0.41) | DPP4HTR2AHTR2CCDK4CCND1 | |
| SCHEMBL3092513 | 0.83 | DPP4 (0.47) | DPP4CYP3A4TAAR1 | |
| SCHEMBL3096850 | 0.82 | DPP4 (0.44) | DPP4CYP3A4 | |
| SCHEMBL3604409 | 0.81 | DPP4 (0.45) | DPP4CYP3A4TAAR1 | |
| SCHEMBL3604955 | 0.80 | DPP4 (0.48) | DPP4CYP1A2CYP3A4CYP2D6NPC1 | |
| SCHEMBL3600802 | 0.78 | DPP4 (0.44) | DPP4 | |
| SCHEMBL3595072 | 0.77 | DPP4 (0.46) | DPP4CYP1A2CYP3A4CYP2D6RAB9A |
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 |