Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIF11 | P52732 | 3/20 | 0.53 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.41 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.41 |
| ▸ | ESR1 | P03372 | 8/20 | 0.41 |
| ▸ | ESR2 | Q92731 | 7/20 | 0.41 |
| ▸ | HSD17B1 | P14061 | 3/20 | 0.41 |
| ▸ | HSD17B2 | P37059 | 3/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | IDO1 | P14902 | 1/20 | 0.38 |
| ▸ | CTSK | P43235 | 1/20 | 0.38 |
| ▸ | NAAA | Q02083 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL14213297 | 0.75 | KIF11 (0.50) | KIF11ABCB1ALOX5ESR1ESR2 | |
| SCHEMBL15545618 | 0.72 | KIF11 (0.56) | KIF11ALOX5ESR1ESR2HSD17B1 | |
| SCHEMBL29895567 | 0.72 | ESR1 (0.70) | KIF11ALOX5ESR1ESR2HSD17B1 | |
| SCHEMBL2403145 | 0.72 | ESR1 (0.70) | KIF11ALOX5ESR1ESR2HSD17B1 | |
| SCHEMBL14409245 | 0.71 | KIF11 (0.46) | KIF11ABCB1ALOX5ESR1ESR2 | |
| SCHEMBL1678985 | 0.71 | MMP3 (0.54) | KIF11ABCB1ESR1ESR2HSD17B1 | |
| SCHEMBL4936502 | 0.71 | RXRA (0.47) | KIF11ESR1ESR2HSD17B1 | |
| SCHEMBL24959842 | 0.71 | MAOB (0.40) | IDO1 | |
| SCHEMBL29901376 | 0.70 | ESR1 (0.57) | KIF11ALOX5ESR1ESR2MEN1 | |
| SCHEMBL9858166 | 0.70 | ESR1 (0.57) | KIF11ALOX5ESR1ESR2MEN1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2870218-B1 | BIMESOGENIC COMPOUNDS AND MESOGENIC MEDIA | MERCK PATENT GMBH (DE) | 2018-05-02 | — | — | EP | disclosed |