Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIF11 | P52732 | 1/20 | 0.38 |
| ▸ | SRC | P12931 | 1/20 | 0.36 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.32 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.32 |
| ▸ | AR | P10275 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | ALDH1A3 | P47895 | 2/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.30 |
| ▸ | GRIA1 | P42261 | 1/20 | 0.30 |
| ▸ | GRIA2 | P42262 | 1/20 | 0.30 |
| ▸ | GRIA3 | P42263 | 1/20 | 0.30 |
| ▸ | GRIA4 | P48058 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL16610338 | 0.81 | KIF11 (0.40) | KIF11AKR1C3AKR1C2ALDH1A1ALDH1A3 | |
| SCHEMBL1859095 | 0.80 | SRC (0.45) | SRCALDH1A1ALDH1A3CYP2A6 | |
| SCHEMBL27233537 | 0.78 | SRC (0.40) | KIF11SRC | |
| SCHEMBL16077415 | 0.75 | SRC (0.45) | KIF11SRCARALDH1A1CYP2A6 | |
| SCHEMBL19948930 | 0.75 | SRC (0.39) | KIF11SRCALDH1A1ALDH1A3SMN1; SMN2 | |
| SCHEMBL1039751 | 0.74 | SMN1; SMN2 (0.41) | ARALDH1A1LMNAHTTSMN1; SMN2 | |
| SCHEMBL22452371 | 0.74 | SRC (0.41) | SRCALDH1A1ALDH1A3CYP2A6 | |
| SCHEMBL13550078 | 0.74 | KDM1A (0.34) | ARLMNAHTTSMN1; SMN2 | |
| SCHEMBL10242061 | 0.74 | NOTUM (0.38) | ARLMNAHTTSMN1; SMN2 | |
| SCHEMBL9712685 | 0.74 | SRC (0.41) | KIF11SRCALDH1A1ALDH1A3CYP2A6 |
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 |
|---|---|---|---|---|---|---|---|
| CN-103958524-A | Fused bicyclic oxazolidinone CETP inhibitor | MERCK SHARP & DOHME | 2014-07-30 | — | — | CN | disclosed |