Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 1/20 | 0.33 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.33 |
| ▸ | ACACB | O00763 | 2/20 | 0.33 |
| ▸ | ACACA | Q13085 | 2/20 | 0.33 |
| ▸ | IDH1 | O75874 | 1/20 | 0.32 |
| ▸ | MDM2 | Q00987 | 3/20 | 0.30 |
| ▸ | TP53 | P04637 | 2/20 | 0.30 |
| ▸ | JAK2 | O60674 | 1/20 | 0.30 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.30 |
| ▸ | MET | P08581 | 1/20 | 0.30 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.30 |
| ▸ | PRKACA | P17612 | 1/20 | 0.30 |
| ▸ | KDR | P35968 | 1/20 | 0.30 |
| ▸ | MAP2K2 | P36507 | 1/20 | 0.30 |
| ▸ | FLT3 | P36888 | 1/20 | 0.30 |
| ▸ | GSK3B | P49841 | 1/20 | 0.30 |
| ▸ | MAP2K1 | Q02750 | 1/20 | 0.30 |
| ▸ | MST1R | Q04912 | 1/20 | 0.30 |
| ▸ | NTRK3 | Q16288 | 1/20 | 0.30 |
| ▸ | NTRK2 | Q16620 | 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 | |
|---|---|---|---|---|
| SCHEMBL12134150 | 0.90 | HDAC1 (0.33) | HDAC1HDAC2ACACBACACAIDH1 | |
| SCHEMBL12134153 | 0.84 | HDAC1 (0.36) | HDAC1HDAC2ACACBACACAIDH1 | |
| SCHEMBL12134147 | 0.79 | ACACB (0.43) | HDAC1HDAC2ACACBACACAJAK2 | |
| SCHEMBL10207870 | 0.78 | KDM1A (0.34) | HDAC1HDAC2ACACBACACAIDH1 | |
| SCHEMBL13273299 | 0.76 | JAK2 (0.36) | ACACBACACATP53JAK2NTRK1 | |
| SCHEMBL10207879 | 0.75 | HDAC1 (0.34) | HDAC1HDAC2ACACBACACA | |
| SCHEMBL10207887 | 0.75 | KDM1A (0.37) | HDAC1HDAC2ACACBACACAIDH1 | |
| SCHEMBL12134155 | 0.74 | ACACB (0.43) | HDAC1HDAC2ACACBACACAJAK2 | |
| SCHEMBL468935 | 0.73 | ACACB (0.36) | ACACBACACAJAK2NTRK1MET | |
| SCHEMBL10248508 | 0.71 | ACACB (0.35) | ACACBACACAJAK2NTRK1MET |
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-2010081687-A1 | USE OF 2-ARYL-5-HETEROCYCLYL-CYCLOHEXANE-L,3-DIONE COMPOUNDS AS INSECTICIDES, ACARICIDES AND / OR FUNGICIDES | BAYER CROPSCIENCE AG (DE) | 2010-07-22 | — | — | WO | disclosed |