Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RORC | P51449 | 4/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | PKM | P14618 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.38 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.35 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.35 |
| ▸ | TACR3 | P29371 | 1/20 | 0.35 |
| ▸ | CNR1 | P21554 | 1/20 | 0.35 |
| ▸ | MLNR | O43193 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
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 | 0.88 | SMN1; SMN2 (0.47) | RORCSMN1; SMN2ALDH1A1PKMMAPT | |
| SCHEMBL20002218 | 0.88 | SMN1; SMN2 (0.47) | RORCSMN1; SMN2ALDH1A1PKMMAPT | |
| SCHEMBL20003082 | 0.85 | SMN1; SMN2 (0.44) | RORCSMN1; SMN2ALDH1A1PKMMAPT | |
| SCHEMBL20002912 | 0.81 | ALDH1A1 (0.52) | SMN1; SMN2ALDH1A1PKMMAPTALOX12 | |
| SCHEMBL20002890 | 0.80 | SMN1; SMN2 (0.48) | RORCSMN1; SMN2ALDH1A1PKMMAPT | |
| SCHEMBL20002762 | 0.77 | ALDH1A1 (0.44) | RORCSMN1; SMN2ALDH1A1PKMMAPT | |
| SCHEMBL20002918 | 0.76 | PKM (0.47) | RORCSMN1; SMN2ALDH1A1PKMPOLB | |
| SCHEMBL20002495 | 0.75 | RORC (0.40) | RORCSMN1; SMN2ALDH1A1PKMMAPT | |
| SCHEMBL20002981 | 0.74 | KDM4E (0.55) | SMN1; SMN2ALDH1A1POLBKDM4ELMNA | |
| SCHEMBL20002706 | 0.73 | HSD11B1 (0.47) | RORCSMN1; SMN2ALDH1A1POLBTSHR |
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 |