Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RORC | P51449 | 6/20 | 0.51 |
| ▸ | PRKAA2 | P54646 | 4/20 | 0.51 |
| ▸ | CXCR3 | P49682 | 2/20 | 0.47 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.43 |
| ▸ | KDM1A | O60341 | 1/20 | 0.43 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.43 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.43 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.41 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | EGLN2 | Q96KS0 | 1/20 | 0.41 |
| ▸ | MLLT3 | P42568 | 1/20 | 0.41 |
| ▸ | MLLT1 | Q03111 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL20903811 | 0.91 | RORC (0.50) | RORCPRKAA2CXCR3EPHX2KDM1A | |
| SCHEMBL20903789 | 0.89 | CXCR3 (0.45) | RORCCXCR3EPHX2NR1H4MLLT3 | |
| SCHEMBL20903757 | 0.88 | MEN1 (0.50) | RORCPRKAA2CXCR3EPHX2NR1H4 | |
| SCHEMBL21277885 | 0.86 | RORC (0.65) | RORCPRKAA2CXCR3EPHX2 | |
| SCHEMBL21277845 | 0.85 | RORC (0.54) | RORCEPHX2KDM1AHDAC1NR1H4 | |
| SCHEMBL20903773 | 0.85 | RORC (0.52) | RORCPRKAA2CXCR3TP53 | |
| SCHEMBL21277703 | 0.83 | RORC (0.52) | RORCCXCR3EPHX2NR1H4MLLT3 | |
| SCHEMBL21277711 | 0.80 | CXCR3 (0.44) | RORCCXCR3 | |
| SCHEMBL20903795 | 0.79 | RORC (0.80) | RORC | |
| SCHEMBL21277787 | 0.79 | RORC (0.53) | RORCKDM1AHDAC1ROCK2 |
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-3527569-A1 | DIHYDROPYRROLOPYRIDINE INHIBITORS OF ROR-GAMMA FOR USE IN TREATING DRYE EYE | Vitae Pharmaceuticals, LLC (US) | 2019-08-21 | — | — | EP | disclosed |