Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.45 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | HTR1D | P28221 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | ESR1 | P03372 | 1/20 | 0.39 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.39 |
| ▸ | RHEB | Q15382 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL180174 | 0.85 | TSHR (0.47) | TSHRMRGPRX4HTTNPSR1ALDH1A1 | |
| SCHEMBL100191 | 0.83 | TSHR (0.50) | TSHRMRGPRX4HTTNPSR1ALDH1A1 | |
| SCHEMBL3918667 | 0.83 | TSHR (0.45) | TSHRMRGPRX4HTTNPSR1ALDH1A1 | |
| SCHEMBL3199958 | 0.83 | PTK2B (0.50) | TSHRHTTNPSR1ALDH1A1KMT2A | |
| SCHEMBL31612517 | 0.82 | MAPK1 (0.49) | TSHRMRGPRX4HTTNPSR1ALDH1A1 | |
| SCHEMBL6691258 | 0.82 | MAPK1 (0.49) | TSHRMRGPRX4HTTNPSR1ALDH1A1 | |
| SCHEMBL9283420 | 0.82 | KMT2A (0.45) | TSHRMRGPRX4HTTNPSR1ALDH1A1 | |
| SCHEMBL10604766 | 0.80 | KMT2A (0.47) | TSHRMRGPRX4HTTNPSR1KMT2A | |
| SCHEMBL3435542 | 0.79 | TSHR (0.55) | TSHRHTTNPSR1ALDH1A1KMT2A | |
| SCHEMBL9066722 | 0.77 | THRB (0.47) | TSHRMRGPRX4HTTNPSR1ALDH1A1 |
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-1329160-A2 | 4-ACYLAMINOPYRAZOLE DERIVATIVES | Sankyo Company, Limited (JP) | 2003-07-23 | — | — | EP | disclosed |