Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RX7 | Q99572 | 1/20 | 0.47 |
| ▸ | PKM | P14618 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.43 |
| ▸ | GRM5 | P41594 | 3/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL20042668 | 0.89 | HPGD (0.51) | P2RX7ALDH1A1GRM5CYP3A4L3MBTL1 | |
| SCHEMBL20042689 | 0.89 | P2RX7 (0.39) | P2RX7GRM5CYP3A4HSP90AA1MAPT | |
| SCHEMBL20042684 | 0.87 | SMN1; SMN2 (0.52) | P2RX7ALDH1A1GRM5CYP1A2CYP3A4 | |
| SCHEMBL20042751 | 0.87 | HSD17B10 (0.49) | P2RX7ALDH1A1KDM4EMEN1KMT2A | |
| SCHEMBL20042839 | 0.87 | P2RX7 (0.45) | P2RX7ALDH1A1L3MBTL1KDM4EMEN1 | |
| SCHEMBL20042886 | 0.86 | HPGD (0.49) | P2RX7PKMKMT2ATSHRHPGD | |
| SCHEMBL20042752 | 0.86 | HPGD (0.47) | P2RX7ALDH1A1MEN1MAPTKMT2A | |
| SCHEMBL20042854 | 0.86 | GRM5 (0.42) | P2RX7GRM5CYP3A4KDM4EMEN1 | |
| SCHEMBL20042667 | 0.85 | TACR3 (0.46) | P2RX7 | |
| SCHEMBL20042674 | 0.85 | P2RX7 (0.37) | P2RX7PKMMEN1HSP90AA1KMT2A |
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 |