Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RORC | P51449 | 5/20 | 0.41 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.35 |
| ▸ | THRB | P10828 | 1/20 | 0.35 |
| ▸ | MMP2 | P08253 | 1/20 | 0.34 |
| ▸ | MMP13 | P45452 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.34 |
| ▸ | PHGDH | O43175 | 1/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | ATM | Q13315 | 1/20 | 0.33 |
| ▸ | FAAH | O00519 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | CNR1 | P21554 | 1/20 | 0.33 |
| ▸ | HTR2A | P28223 | 1/20 | 0.33 |
| ▸ | HTR7 | P34969 | 1/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 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 | |
|---|---|---|---|---|
| SCHEMBL20002171 | 0.87 | KMT2A (0.38) | RORCHSD11B1SMN1; SMN2NPC1RAB9A | |
| SCHEMBL20002187 | 0.86 | RORC (0.44) | RORCHSD11B1THRBMMP2MMP13 | |
| SCHEMBL20002819 | 0.86 | RORC (0.44) | RORCHSD11B1THRBMMP2MMP13 | |
| SCHEMBL20002207 | 0.86 | RORC (0.45) | RORCNPC1RAB9AATM | |
| SCHEMBL20002926 | 0.86 | RORC (0.43) | RORCMAPK1KCNH2 | |
| SCHEMBL20002924 | 0.85 | MAPK1 (0.34) | RORCHSD11B1NPC1RAB9AATM | |
| SCHEMBL20002566 | 0.83 | RORC (0.46) | RORCHSD11B1THRBMMP2MMP13 | |
| SCHEMBL20003049 | 0.81 | AKR1C3 (0.51) | HSD11B1SMN1; SMN2AKR1C3PHGDHPKM | |
| SCHEMBL20002400 | 0.81 | TACR3 (0.42) | RORCHSD11B1MMP2MMP13SMN1; SMN2 | |
| SCHEMBL20003044 | 0.80 | RORC (0.40) | RORCSMN1; SMN2NPC1RAB9AATM |
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 |