Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | DRD4 | P21917 | 1/20 | 0.43 |
| ▸ | DPP4 | P27487 | 1/20 | 0.42 |
| ▸ | DPP8 | Q6V1X1 | 1/20 | 0.42 |
| ▸ | DPP9 | Q86TI2 | 1/20 | 0.42 |
| ▸ | DPP7 | Q9UHL4 | 1/20 | 0.42 |
| ▸ | HTR2A | P28223 | 1/20 | 0.41 |
| ▸ | CCR5 | P51681 | 3/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.41 |
| ▸ | MGLL | Q99685 | 2/20 | 0.41 |
| ▸ | CCR2 | P41597 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL11375020 | 0.77 | DPP4 (0.50) | HTTDPP4DPP8DPP9DPP7 | |
| SCHEMBL11980678 | 0.73 | SCD5 (0.48) | DPP4 | |
| SCHEMBL18862998 | 0.72 | HTT (0.50) | HTTHTR2ALMNAMAPTMAPK1 | |
| SCHEMBL17542110 | 0.72 | HTT (0.50) | HTTHTR2ALMNAMAPTMAPK1 | |
| SCHEMBL27698658 | 0.72 | MEN1 (0.43) | DPP4SMN1; SMN2 | |
| SCHEMBL28334406 | 0.70 | MAPT (0.52) | HTTLMNAMAPTMAPK1SMN1; SMN2 | |
| SCHEMBL6770592 | 0.70 | SPHK1 (0.45) | DPP4DPP8DPP9DPP7LMNA | |
| SCHEMBL7159404 | 0.70 | SPHK1 (0.45) | DPP4DPP8DPP9DPP7LMNA | |
| SCHEMBL11928204 | 0.70 | HTR2A (0.47) | HTTDRD4HTR2ACCR5LMNA | |
| SCHEMBL11928206 | 0.70 | HTR2A (0.47) | HTTDRD4HTR2ACCR5LMNA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009124166-A1 | HYDROXYMETHYL PYRROLIDINES AS BETA 3 ADRENERGIC RECEPTOR AGONISTS | MERCK & CO., INC. (US) | 2009-10-08 | — | — | WO | disclosed |