Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.56 |
| ▸ | KCNN4 | O15554 | 3/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.45 |
| ▸ | RECQL | P46063 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | KIF11 | P52732 | 2/20 | 0.41 |
| ▸ | PRMT1 | Q99873 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL8285883 | 0.80 | KCNN4 (0.50) | TAAR1KCNN4CYP1A2CYP3A4RECQL | |
| SCHEMBL25014080 | 0.78 | KCNN4 (0.48) | TAAR1KCNN4CYP1A2CYP3A4RECQL | |
| SCHEMBL29086464 | 0.78 | KCNN4 (0.48) | TAAR1KCNN4CYP1A2CYP3A4RECQL | |
| SCHEMBL5328364 | 0.77 | LMNA (0.61) | TAAR1KCNN4CYP1A2CYP3A4RECQL | |
| SCHEMBL27798202 | 0.75 | KCNN4 (0.45) | TAAR1KCNN4CYP1A2CYP3A4RECQL | |
| SCHEMBL27798201 | 0.75 | KCNN4 (0.45) | TAAR1KCNN4CYP1A2CYP3A4RECQL | |
| Hydrochloric Acid SCHEMBL7273940 | 0.75 | LMNA (0.59) | TAAR1KCNN4CYP1A2CYP3A4RECQL | |
| Hydrochloric Acid SCHEMBL27715222 | 0.74 | TAAR1 (0.50) | TAAR1KCNN4CYP3A4MAPK1CYP2D6 | |
| SCHEMBL9711508 | 0.74 | CYP2C19 (0.60) | KCNN4CYP1A2CYP3A4RECQLMAPK1 | |
| SCHEMBL1930180 | 0.74 | NPC1 (0.46) | TAAR1CYP1A2CYP3A4RECQLMAPK1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110546150-B | Pyrazolyl-containing tricyclic derivatives, preparation method and application thereof | 江苏豪森药业集团有限公司 | 2021-12-21 | — | — | CN | disclosed |
| CN-110546150-A | Pyrazolyl-containing tricyclic derivatives, preparation method and application thereof | JIANGSU HANSOH PHARMACEUTICAL GROUP CO LTD | 2019-12-06 | — | — | CN | disclosed |