Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | GRB2 | P62993 | 1/20 | 0.35 |
| ▸ | ACACB | O00763 | 3/20 | 0.33 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.33 |
| ▸ | MMP13 | P45452 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL21574645 | 0.80 | TP53 (0.41) | TP53TSHRGRB2ACACBPTPN1 | |
| SCHEMBL21538871 | 0.75 | HTR2A (0.55) | TP53TSHR | |
| SCHEMBL21076020 | 0.74 | PPARG (0.38) | TP53TSHR | |
| SCHEMBL21574736 | 0.73 | IDO1 (0.39) | — | |
| SCHEMBL21573071 | 0.73 | HRH3 (0.37) | TP53TSHR | |
| SCHEMBL19143516 | 0.69 | GRB2 (0.55) | GRB2ACACBPTPN1 | |
| SCHEMBL11932058 | 0.67 | TAAR1 (0.37) | TP53TSHRPTPN1 | |
| SCHEMBL24202494 | 0.66 | CPA1 (0.41) | MMP13 | |
| SCHEMBL1742369 | 0.66 | EPHX2 (0.44) | TSHR | |
| SCHEMBL21075947 | 0.65 | TAAR1 (0.45) | — |
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-2909192-B1 | METHYLENE LINKED QUINOLINYL MODULATORS OF ROR-GAMMA-T | JANSSEN PHARMACEUTICA NV (BE) | 2017-05-17 | — | — | EP | disclosed |