Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RX7 | Q99572 | 4/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.35 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | THRB | P10828 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | GBA1 | P04062 | 1/20 | 0.34 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.33 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | PDE4B | Q07343 | 2/20 | 0.33 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.33 |
| ▸ | CFTR | P13569 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.32 |
| ▸ | PDE4A | P27815 | 1/20 | 0.32 |
| ▸ | PDE4C | Q08493 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL20042873 | 0.89 | P2RX7 (0.38) | P2RX7HCAR2HSP90AA1GBA1HSD17B10 | |
| SCHEMBL20042689 | 0.89 | P2RX7 (0.39) | P2RX7HSP90AA1TP53THRBTDP1 | |
| SCHEMBL20042854 | 0.86 | GRM5 (0.42) | P2RX7HSP90AA1TP53THRBTDP1 | |
| SCHEMBL20042771 | 0.85 | P2RX7 (0.47) | P2RX7PKMHSP90AA1MEN1KMT2A | |
| SCHEMBL20042751 | 0.84 | HSD17B10 (0.49) | P2RX7GBA1HSD17B10MEN1KMT2A | |
| SCHEMBL20042720 | 0.84 | GRM5 (0.41) | P2RX7HSP90AA1 | |
| SCHEMBL20042863 | 0.84 | GRM5 (0.42) | P2RX7TP53THRBTDP1GBA1 | |
| SCHEMBL20042832 | 0.84 | CFTR (0.45) | P2RX7PKMTDP1CFTRMEN1 | |
| SCHEMBL20042776 | 0.82 | P2RX7 (0.41) | P2RX7HCAR2GBA1CFTRMEN1 | |
| SCHEMBL20042743 | 0.82 | P2RX7 (0.40) | P2RX7GBA1HSD17B10CHRM4 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2018066718-A1 | THERAPEUTIC COMPOUNDS | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2018-04-12 | — | — | WO | disclosed |