Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RY1 | P47900 | 3/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | NTRK1 | P04629 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | STAT1 | P42224 | 1/20 | 0.41 |
| ▸ | SOAT2 | O75908 | 4/20 | 0.40 |
| ▸ | SOAT1 | P35610 | 4/20 | 0.40 |
| ▸ | GAA | P10253 | 3/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | KCNJ6 | P48051 | 1/20 | 0.38 |
| ▸ | KCNJ5 | P48544 | 1/20 | 0.38 |
| ▸ | KCNJ3 | P48549 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 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 | |
|---|---|---|---|---|
| SCHEMBL21753644 | 1.00 | P2RY1 (0.43) | P2RY1L3MBTL1ALDH1A1NTRK1LMNA | |
| SCHEMBL21753629 | 0.82 | P2RY1 (0.51) | P2RY1L3MBTL1ALDH1A1NTRK1LMNA | |
| SCHEMBL21753653 | 0.79 | P2RY1 (0.48) | P2RY1L3MBTL1ALDH1A1NTRK1GAA | |
| SCHEMBL21753627 | 0.78 | ALDH1A1 (0.48) | P2RY1L3MBTL1ALDH1A1NTRK1LMNA | |
| SCHEMBL21753616 | 0.77 | ALDH1A1 (0.50) | P2RY1L3MBTL1ALDH1A1NTRK1LMNA | |
| SCHEMBL21753632 | 0.74 | ALDH1A1 (0.43) | P2RY1L3MBTL1ALDH1A1NTRK1LMNA | |
| SCHEMBL21774371 | 0.74 | SOAT2 (0.43) | L3MBTL1ALDH1A1NTRK1LMNASTAT1 | |
| SCHEMBL21774356 | 0.73 | SOAT2 (0.46) | L3MBTL1ALDH1A1NTRK1LMNASTAT1 | |
| SCHEMBL21753619 | 0.73 | NTRK1 (0.50) | P2RY1L3MBTL1ALDH1A1NTRK1LMNA | |
| SCHEMBL21775898 | 0.72 | SOAT2 (0.51) | L3MBTL1ALDH1A1NTRK1LMNASTAT1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110857285-B | Substituted pyrazole compound, preparation method, pharmaceutical composition and application thereof | 江苏万高药业股份有限公司 | 2022-12-20 | — | — | CN | disclosed |
| CN-110857285-A | Substituted pyrazole compound, preparation method, pharmaceutical composition and application thereof | 天津谷堆生物医药科技有限公司 | 2020-03-03 | — | — | CN | disclosed |
| WO-2020038279-A1 | SUBSTITUTED PYRAZOLE COMPOUND, AND PREPARATION METHOD, PHARMACEUTICAL COMPOSITION, AND USE THEREOF | 天津谷堆生物医药科技有限公司 | 2020-02-27 | — | — | WO | disclosed |