Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DPP4 | P27487 | 3/20 | 0.49 |
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.46 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.46 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | ACHE | P22303 | 1/20 | 0.38 |
| ▸ | ESR1 | P03372 | 2/20 | 0.37 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.37 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.36 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL3598731 | 0.84 | DPP4 (0.40) | DPP4TAAR1SLC6A2MAPTL3MBTL1 | |
| SCHEMBL27478385 | 0.83 | DPP4 (0.51) | DPP4TAAR1SLC6A2 | |
| SCHEMBL5787568 | 0.80 | DPP4 (0.49) | DPP4SLC6A2 | |
| SCHEMBL6623745 | 0.76 | SLC6A2 (0.50) | DPP4SLC6A2 | |
| SCHEMBL27602391 | 0.74 | SLC6A2 (0.40) | DPP4SLC6A2 | |
| SCHEMBL27288939 | 0.73 | GBA1 (0.43) | DPP4TAAR1SLC6A2 | |
| SCHEMBL5188989 | 0.72 | PNMT (0.53) | DPP4TAAR1SLC6A2 | |
| SCHEMBL8281716 | 0.72 | PNMT (0.53) | DPP4TAAR1SLC6A2 | |
| Tyrosine SCHEMBL3720826 | 0.71 | SLC7A5 (0.83) | SLC7A5MAPTKDM4EACHEHDAC8 | |
| SCHEMBL5671019 | 0.70 | TAAR1 (0.50) | TAAR1SLC6A2SLC7A5ESR1ESR2 |
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-6172076-B1 | HETEROCYCLE-SUBSTITUTED 1,3,8-TRIAZASPIRO(4,5)DECANE DERIVATIVES; TREATING ARTERIOSCLEROSIS | MERCK & CO., INC. | 2001-01-09 | — | — | US | disclosed |