Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 4/20 | 0.42 |
| ▸ | MEN1 | O00255 | 3/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.42 |
| ▸ | MAPT | P10636 | 3/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | CA12 | O43570 | 3/20 | 0.39 |
| ▸ | CA1 | P00915 | 3/20 | 0.39 |
| ▸ | CA2 | P00918 | 3/20 | 0.39 |
| ▸ | CA7 | P43166 | 3/20 | 0.39 |
| ▸ | CA9 | Q16790 | 3/20 | 0.39 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.39 |
| ▸ | ESR1 | P03372 | 1/20 | 0.39 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.38 |
| ▸ | LMNA | P02545 | 3/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.38 |
| ▸ | NR1H3 | Q13133 | 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 | |
|---|---|---|---|---|
| SCHEMBL16863288 | 0.75 | KMT2A (0.40) | KMT2AMEN1KDM4EMAPTALOX15 | |
| SCHEMBL1284263 | 0.75 | ALDH1A1 (0.41) | KMT2AMEN1KDM4EMAPTALOX15 | |
| SCHEMBL9797391 | 0.73 | KDM4E (0.48) | KMT2AMEN1KDM4EMAPTALOX15 | |
| SCHEMBL20161452 | 0.73 | FUCA1 (0.39) | KMT2AMEN1KDM4EMAPTALOX15 | |
| SCHEMBL23757667 | 0.73 | ATM (0.42) | KMT2AMEN1KDM4EMAPTALOX15 | |
| SCHEMBL4448027 | 0.70 | KMT2A (0.42) | KMT2AMEN1KDM4EMAPTALOX15 | |
| SCHEMBL12659213 | 0.70 | CHRM3 (0.43) | KMT2AMEN1KDM4EMAPTALOX15 | |
| SCHEMBL10447298 | 0.70 | TSHR (0.48) | KMT2AMEN1KDM4EMAPTALOX15 | |
| SCHEMBL43932 | 0.70 | — | — | |
| SCHEMBL29093155 | 0.69 | KMT2A (0.40) | KMT2AMEN1KDM4EMAPTALOX15 |
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-3704112-A1 | ALKENE SPIROCYCLIC COMPOUNDS AS FARNESOID X RECEPTOR MODULATORS | Bristol-Myers Squibb Company (US) | 2020-09-09 | — | — | EP | disclosed |