Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.53 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | HSD11B1 | P28845 | 2/20 | 0.38 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.38 |
| ▸ | CNR2 | P34972 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | CNR1 | P21554 | 1/20 | 0.38 |
| ▸ | PGR | P06401 | 1/20 | 0.37 |
| ▸ | RORA | P35398 | 1/20 | 0.37 |
| ▸ | RORC | P51449 | 1/20 | 0.37 |
| ▸ | RORB | Q92753 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL18152846 | 0.69 | TSHR (0.61) | TSHRTP53NR1H3MEN1KMT2A | |
| SCHEMBL28010239 | 0.69 | TSHR (0.61) | TSHRNR1H3MEN1KMT2ATDP1 | |
| SCHEMBL31026230 | 0.68 | TSHR (0.48) | TSHRTP53NR1H3MEN1KMT2A | |
| SCHEMBL18152774 | 0.67 | TSHR (0.50) | TSHRTP53NR1H3MEN1KMT2A | |
| SCHEMBL6617277 | 0.66 | TSHR (0.56) | TSHRTP53NR1H3GAAL3MBTL1 | |
| SCHEMBL6562979 | 0.66 | ALDH1A1 (0.62) | TSHRGAAMEN1KMT2ATDP1 | |
| SCHEMBL9321137 | 0.66 | TP53 (0.72) | TSHRTP53GAAALDH1A1TLR8 | |
| SCHEMBL4616302 | 0.65 | TSHR (0.47) | TSHRNR1H3MEN1KMT2ATDP1 | |
| SCHEMBL18152809 | 0.65 | TSHR (0.65) | TSHRTP53NR1H3ALDH1A1HSD11B1 | |
| SCHEMBL13304800 | 0.65 | TSHR (0.51) | TSHRALDH1A1CNR2HPGDPGR |
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-1322309-B1 | HIGH AFFINITY SMALL MOLECULE C5A RECEPTOR MODULATORS | NEUROGEN CORP (US) | 2008-08-13 | — | — | EP | disclosed |