Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS3 | P29474 | 1/20 | 0.32 |
| ▸ | NOS2 | P35228 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | NOS1 | P29475 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL20789355 | 0.79 | ADORA3 (0.31) | NOS3NOS2 | |
| SCHEMBL4770134 | 0.77 | KIF11 (0.36) | NOS3NOS2ALDH1A1TSHRNOS1 | |
| SCHEMBL2053635 | 0.74 | NOS3 (0.35) | NOS3NOS2ALDH1A1TSHRNOS1 | |
| SCHEMBL21178116 | 0.73 | DRD4 (0.40) | NOS3NOS2ALDH1A1TSHRNOS1 | |
| SCHEMBL21178152 | 0.73 | DRD4 (0.40) | NOS3NOS2ALDH1A1TSHRNOS1 | |
| SCHEMBL21178115 | 0.73 | DRD4 (0.40) | NOS3NOS2ALDH1A1TSHRNOS1 | |
| SCHEMBL2014387 | 0.71 | ALDH1A1 (0.34) | NOS3NOS2ALDH1A1TSHRNOS1 | |
| SCHEMBL24676709 | 0.70 | DRD4 (0.36) | NOS3NOS2ALDH1A1TSHRNOS1 | |
| SCHEMBL2043681 | 0.69 | KIF11 (0.31) | — | |
| SCHEMBL28089091 | 0.68 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2513098-A1 | AMINOPYRIMIDINES AS SYK INHIBITORS | Merck Sharp & Dohme Corp. (US) | 2012-10-24 | — | — | EP | disclosed |
| WO-2011075515-A1 | AMINOPYRIMIDINES AS SYK INHIBITORS | MERCK SHARP & DOHME CORP. (US) | 2011-06-23 | — | — | WO | disclosed |