Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RORC | P51449 | 8/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | MITF | O75030 | 1/20 | 0.35 |
| ▸ | ALPG | P10696 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 2/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | PTGFR | P43088 | 1/20 | 0.33 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.33 |
| ▸ | TCF7L2 | Q9NQB0 | 1/20 | 0.33 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.33 |
| ▸ | BCHE | P06276 | 1/20 | 0.33 |
| ▸ | ACHE | P22303 | 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 | |
|---|---|---|---|---|
| SCHEMBL16632658 | 0.80 | RORC (0.57) | RORCCYP1A2CTNNB1TCF7L2 | |
| SCHEMBL16632413 | 0.67 | RORC (0.55) | RORC | |
| SCHEMBL16460911 | 0.64 | CYP1A2 (0.45) | RORCALDH1A1KDM4ELMNAMAPT | |
| SCHEMBL16462100 | 0.64 | CYP1A2 (0.61) | RORCCYP1A2 | |
| SCHEMBL15647927 | 0.63 | RORC (0.47) | RORCCYP1A2 | |
| SCHEMBL21574565 | 0.63 | CYP1A2 (0.41) | RORCALDH1A1KDM4ELMNAKMT2A | |
| SCHEMBL16460893 | 0.62 | RORC (0.41) | RORCALDH1A1KDM4ELMNAMAPT | |
| SCHEMBL15648267 | 0.62 | CYP1A2 (0.52) | RORCCYP1A2 | |
| Hydrochloric Acid SCHEMBL5578269 | 0.62 | KDM4E (0.74) | ALDH1A1KDM4ELMNAMAPTKMT2A | |
| SCHEMBL15647695 | 0.62 | RORC (0.63) | RORC |
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-3057949-B1 | SECONDARY ALCOHOL QUINOLINYL MODULATORS OF ROR GAMMA T | JANSSEN PHARMACEUTICA NV (BE) | 2019-06-05 | — | — | EP | disclosed |