Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | CASP1 | P29466 | 1/20 | 0.40 |
| ▸ | CASP7 | P55210 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | P2RX7 | Q99572 | 4/20 | 0.36 |
| ▸ | LMNA | P02545 | 4/20 | 0.36 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | ACLY | P53396 | 2/20 | 0.35 |
| ▸ | LRRK2 | Q5S007 | 2/20 | 0.35 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL20042680 | 0.87 | GPR6 (0.44) | TSHRKDM4EHPGDCASP1CASP7 | |
| SCHEMBL20042689 | 0.86 | P2RX7 (0.39) | CASP1CASP7HSD17B10P2RX7SMN1; SMN2 | |
| SCHEMBL20042886 | 0.85 | HPGD (0.49) | TSHRHPGDP2RX7KMT2AHSD11B1 | |
| SCHEMBL20042752 | 0.85 | HPGD (0.47) | TSHRHPGDP2RX7LMNASMN1; SMN2 | |
| SCHEMBL20042743 | 0.83 | P2RX7 (0.40) | TSHRKDM4EHPGDCASP1CASP7 | |
| SCHEMBL20042720 | 0.83 | GRM5 (0.41) | P2RX7HSP90AA1 | |
| SCHEMBL20042854 | 0.83 | GRM5 (0.42) | TSHRKDM4EHPGDCASP1CASP7 | |
| SCHEMBL20042667 | 0.82 | TACR3 (0.46) | P2RX7 | |
| SCHEMBL20042887 | 0.82 | GPR6 (0.42) | TSHRHPGDP2RX7SMN1; SMN2ALDH1A1 | |
| SCHEMBL20042751 | 0.81 | HSD17B10 (0.49) | KDM4EHPGDCASP1CASP7HSD17B10 |
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 |