Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PKM | P14618 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | GFER | P55789 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 4/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | RORC | P51449 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | MC4R | P32245 | 2/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.34 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL20002209 | 0.79 | SMN1; SMN2 (0.47) | PKMALDH1A1SMN1; SMN2LMNARORC | |
| SCHEMBL20002218 | 0.79 | SMN1; SMN2 (0.47) | PKMALDH1A1SMN1; SMN2LMNARORC | |
| SCHEMBL20003082 | 0.78 | SMN1; SMN2 (0.44) | PKMALDH1A1SMN1; SMN2LMNARORC | |
| SCHEMBL20003187 | 0.76 | RORC (0.43) | PKMALDH1A1SMN1; SMN2LMNARORC | |
| SCHEMBL20002912 | 0.76 | ALDH1A1 (0.52) | PKMALDH1A1SMN1; SMN2KMT2ALMNA | |
| SCHEMBL20002890 | 0.75 | SMN1; SMN2 (0.48) | PKMALDH1A1SMN1; SMN2KMT2ALMNA | |
| SCHEMBL20002495 | 0.72 | RORC (0.40) | PKMALDH1A1SMN1; SMN2KMT2ARAB9A | |
| SCHEMBL20002931 | 0.72 | PDK2 (0.39) | ALDH1A1SMN1; SMN2RORCPOLB | |
| SCHEMBL30730486 | 0.71 | KMT2A (0.45) | PKMALDH1A1GFERKMT2ALMNA | |
| SCHEMBL30730484 | 0.71 | LMNA (0.49) | PKMALDH1A1GFERSMN1; SMN2KMT2A |
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-3092229-B1 | PYRROLIDINYL SULFONE DERIVATIVES AND THEIR USE AS ROR GAMMA MODULATORS | BRISTOL MYERS SQUIBB CO (US) | 2018-03-28 | — | — | EP | disclosed |