Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.40 |
| ▸ | USP2 | O75604 | 2/20 | 0.40 |
| ▸ | CA1 | P00915 | 4/20 | 0.35 |
| ▸ | CA2 | P00918 | 4/20 | 0.35 |
| ▸ | CA7 | P43166 | 2/20 | 0.35 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | TERT | O14746 | 2/20 | 0.33 |
| ▸ | GPR88 | Q9GZN0 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | DPP7 | Q9UHL4 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | RRM1 | P23921 | 1/20 | 0.31 |
| ▸ | GRIA1 | P42261 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL28646996 | 0.77 | TSHR (0.35) | TSHRUSP2CA1CA2CA7 | |
| SCHEMBL30269173 | 0.77 | TERT (0.40) | TSHRL3MBTL1TERTGPR88TP53 | |
| SCHEMBL17841877 | 0.77 | TERT (0.40) | TSHRL3MBTL1TERTGPR88TP53 | |
| SCHEMBL18664263 | 0.73 | TSHR (0.57) | TSHRUSP2CA1CA2CA7 | |
| SCHEMBL19432330 | 0.73 | TSHR (0.57) | TSHRUSP2CA1CA2CA7 | |
| SCHEMBL18664311 | 0.73 | TSHR (0.57) | TSHRUSP2CA1CA2CA7 | |
| SCHEMBL11810200 | 0.73 | TSHR (0.74) | TSHRUSP2CA1CA2CA7 | |
| SCHEMBL4418973 | 0.71 | GABBR2 (0.35) | GAAALDH1A1 | |
| Trifluoroacetic Acid SCHEMBL27959221 | 0.71 | ALDH1A1 (0.35) | ALDH1A1 | |
| Trifluoroacetic Acid SCHEMBL18261734 | 0.69 | AKT1 (0.38) | TSHRL3MBTL1TERT |
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-3086814-B1 | DRUG CONJUGATES (ADCS) WITH KINESIN SPINDEL PROTEIN (KSP) | Bayer Pharma AG (DE) | 2020-06-24 | — | — | EP | disclosed |