Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB2 | P07550 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.41 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.38 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.38 |
| ▸ | BRD4 | O60885 | 1/20 | 0.38 |
| ▸ | CYP19A1 | P11511 | 3/20 | 0.37 |
| ▸ | IDO1 | P14902 | 2/20 | 0.37 |
| ▸ | TDO2 | P48775 | 2/20 | 0.37 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.34 |
| ▸ | FFAR2 | O15552 | 1/20 | 0.33 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.33 |
| ▸ | HDAC7 | Q8WUI4 | 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 | |
|---|---|---|---|---|
| SCHEMBL8802618 | 0.78 | CHRNA7 (0.41) | TDP1CYP19A1 | |
| SCHEMBL11572011 | 0.75 | SLC6A4 (0.48) | ADRB2TSHRMAPK1HIF1ATDP1 | |
| SCHEMBL6295188 | 0.75 | DPP4 (0.38) | TSHRHIF1ATDP1LMNA | |
| SCHEMBL1145645 | 0.73 | ADRB2 (0.52) | ADRB2TSHRMAPK1HIF1ATDP1 | |
| SCHEMBL1003900 | 0.72 | ADRB2 (0.56) | ADRB2TSHRMAPK1HIF1ATDP1 | |
| SCHEMBL3754314 | 0.72 | ADRB2 (0.56) | ADRB2TSHRMAPK1HIF1ATDP1 | |
| SCHEMBL3745333 | 0.72 | ADRB2 (0.56) | ADRB2TSHRMAPK1HIF1ATDP1 | |
| SCHEMBL8041464 | 0.71 | CYP3A4 (0.43) | TSHRMAPK1LMNACYP19A1SLC6A4 | |
| SCHEMBL3535353 | 0.71 | TSHR (0.50) | ADRB2TSHRMAPK1HIF1ATDP1 | |
| SCHEMBL25304239 | 0.70 | ADRB2 (0.54) | ADRB2TSHRMAPK1HIF1ATDP1 |
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-0347146-B1 | FUSED PYRIMIDINE DERIVATIVES, PROCESS AND INTERMEDIATES FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) | 1993-09-01 | — | — | EP | claimed |