Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC3 | O15379 | 1/20 | 0.54 |
| ▸ | CA12 | O43570 | 1/20 | 0.54 |
| ▸ | CA1 | P00915 | 1/20 | 0.54 |
| ▸ | IDO1 | P14902 | 1/20 | 0.54 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.54 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.54 |
| ▸ | CA9 | Q16790 | 1/20 | 0.54 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.54 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.54 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.54 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.54 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.54 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.54 |
| ▸ | LMNA | P02545 | 2/20 | 0.50 |
| ▸ | MEN1 | O00255 | 2/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.50 |
| ▸ | FLT1 | P17948 | 1/20 | 0.50 |
| ▸ | FLT4 | P35916 | 1/20 | 0.50 |
| ▸ | KDR | P35968 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL5819670 | 0.89 | CA12 (0.65) | HDAC3CA12CA1IDO1ALOX15 | |
| SCHEMBL11289818 | 0.82 | HDAC3 (0.56) | HDAC3CA12CA1IDO1ALOX15 | |
| SCHEMBL364110 | 0.79 | HDAC3 (0.58) | HDAC3CA12CA1IDO1ALOX15 | |
| Hydrochloric Acid SCHEMBL4438185 | 0.78 | P4HTM (0.56) | HDAC3CA12CA1IDO1ALOX15 | |
| SCHEMBL974471 | 0.78 | KMT2A (0.56) | HDAC3CA12CA1IDO1ALOX15 | |
| SCHEMBL10915393 | 0.77 | HDAC3 (0.50) | HDAC3CA12CA1IDO1ALOX15 | |
| Benzohydroxamate SCHEMBL20480857 | 0.77 | HDAC6 (0.82) | HDAC3CA12CA1IDO1ALOX15 | |
| SCHEMBL3729389 | 0.77 | CA12 (0.60) | HDAC3CA12CA1IDO1ALOX15 | |
| Dimethylamine SCHEMBL15266781 | 0.76 | HDAC3 (0.54) | HDAC3CA12CA1IDO1ALOX15 | |
| SCHEMBL1370670 | 0.76 | LMNA (0.54) | HDAC3CA12CA1IDO1ALOX15 |
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-102264226-B | Bicyclooctane-1, the 3-derovatives of phenyl-replacement | BAYER INTELLECTUAL PROPERTY GMBH (DE) | 2015-12-16 | — | — | CN | disclosed |