Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RORC | P51449 | 7/20 | 0.47 |
| ▸ | TACR3 | P29371 | 1/20 | 0.44 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.43 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.43 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.43 |
| ▸ | HSD11B1 | P28845 | 5/20 | 0.39 |
| ▸ | CCNT1 | O60563 | 2/20 | 0.37 |
| ▸ | CDK9 | P50750 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.35 |
| ▸ | JAK2 | O60674 | 1/20 | 0.35 |
| ▸ | LCK | P06239 | 1/20 | 0.35 |
| ▸ | RET | P07949 | 1/20 | 0.35 |
| ▸ | PRKACA | P17612 | 1/20 | 0.35 |
| ▸ | LTK | P29376 | 1/20 | 0.35 |
| ▸ | KDR | P35968 | 1/20 | 0.35 |
| ▸ | GSK3A | P49840 | 1/20 | 0.35 |
| ▸ | PRKX | P51817 | 1/20 | 0.35 |
| ▸ | JAK3 | P52333 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL20002987 | 0.95 | TACR3 (0.49) | RORCTACR3NR1I2NR1H2NR1H3 | |
| SCHEMBL20002495 | 0.87 | RORC (0.40) | RORCNR1I2HSD11B1MAPTPKM | |
| SCHEMBL20002698 | 0.81 | HSD11B1 (0.47) | RORCHSD11B1KMT2A | |
| SCHEMBL20002706 | 0.81 | HSD11B1 (0.47) | RORCHSD11B1KMT2A | |
| SCHEMBL20002564 | 0.79 | NAMPT (0.41) | HSD11B1KMT2ALMNA | |
| SCHEMBL20002286 | 0.79 | TACR1 (0.45) | RORCTACR3NR1I2 | |
| SCHEMBL20002751 | 0.78 | NOTUM (0.42) | RORCMAPT | |
| SCHEMBL20002685 | 0.78 | HSD11B1 (0.41) | RORCHSD11B1MAPTPKMALOX12 | |
| SCHEMBL20002854 | 0.78 | RORC (0.42) | RORCHSD11B1MAPTPKMALOX12 | |
| SCHEMBL20002400 | 0.77 | TACR3 (0.42) | RORCTACR3HSD11B1MAPTKMT2A |
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 |