Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIF11 | P52732 | 5/20 | 0.47 |
| ▸ | RXRA | P19793 | 2/20 | 0.46 |
| ▸ | RXRB | P28702 | 2/20 | 0.46 |
| ▸ | DHODH | Q02127 | 1/20 | 0.45 |
| ▸ | ASIC1 | P78348 | 1/20 | 0.45 |
| ▸ | CNR1 | P21554 | 1/20 | 0.43 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | F9 | P00740 | 1/20 | 0.37 |
| ▸ | CA12 | O43570 | 1/20 | 0.37 |
| ▸ | CA9 | Q16790 | 1/20 | 0.37 |
| ▸ | IDO1 | P14902 | 1/20 | 0.37 |
| ▸ | XDH | P47989 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL26674224 | 0.86 | KIF11 (0.58) | KIF11RXRARXRBCNR1ALDH1A1 | |
| SCHEMBL30677943 | 0.86 | KIF11 (0.58) | KIF11RXRARXRBCNR1ALDH1A1 | |
| SCHEMBL19585564 | 0.85 | DHODH (0.56) | KIF11RXRARXRBDHODHASIC1 | |
| SCHEMBL25384882 | 0.84 | RXRB (0.54) | KIF11RXRARXRBDHODHASIC1 | |
| SCHEMBL22793707 | 0.81 | DHODH (0.57) | KIF11RXRARXRBDHODHASIC1 | |
| SCHEMBL17105790 | 0.81 | KIF11 (0.68) | KIF11RXRARXRBDHODHASIC1 | |
| SCHEMBL26530694 | 0.80 | KIF11 (0.52) | KIF11RXRARXRBDHODHASIC1 | |
| SCHEMBL20999999 | 0.78 | MAOA (0.48) | HSD17B2ALDH1A1MAPTIDO1 | |
| SCHEMBL22931514 | 0.78 | HSD17B1 (0.44) | HSD17B2CA12CA9IDO1 | |
| SCHEMBL14707718 | 0.78 | KIF11 (0.56) | KIF11TSHRALDH1A1XDH |
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-1663936-B1 | BIARYLOXYMETHYLARENE-CARBOXYLIC ACIDS | HOFFMANN LA ROCHE (CH) | 2008-01-09 | — | — | EP | disclosed |
| CN-1684944-A | method for copper-catalyzed formation of carbon-heteroatom and carbon-carbon bonds | MASSACHUSETTS INST TECHNOLOGY (US) | 2005-10-19 | — | — | CN | disclosed |