Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | IKBKB | O14920 | 2/20 | 0.34 |
| ▸ | LMNA | P02545 | 3/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | IRAK4 | Q9NWZ3 | 3/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | NPBWR1 | P48145 | 1/20 | 0.32 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 2/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL28511557 | 0.82 | LMNA (0.40) | CYP1A2CYP2C19LMNASMN1; SMN2KDM4E | |
| SCHEMBL29045179 | 0.81 | CHEK1 (0.35) | CYP1A2CYP2C19LMNAKDM4EALDH1A1 | |
| SCHEMBL24485511 | 0.77 | KCNH2 (0.52) | CYP2C19 | |
| SCHEMBL29045194 | 0.70 | CYP1A2 (0.35) | CYP1A2CYP2C19IKBKBLMNASMN1; SMN2 | |
| SCHEMBL29045170 | 0.68 | CHEK1 (0.47) | CYP1A2IKBKBLMNASMN1; SMN2KDM4E | |
| SCHEMBL31355169 | 0.67 | KMT2A (0.36) | LMNASMN1; SMN2ALDH1A1L3MBTL1KMT2A | |
| SCHEMBL7040741 | 0.66 | IKBKB (0.50) | IKBKBKDM4EALDH1A1L3MBTL1MAPK1 | |
| SCHEMBL11633512 | 0.64 | ALDH1A1 (0.41) | IKBKBLMNASMN1; SMN2KDM4EALDH1A1 | |
| SCHEMBL25792329 | 0.64 | CA12 (0.47) | CYP1A2CYP2C19LMNAKDM4EALDH1A1 | |
| SCHEMBL26668644 | 0.64 | MTNR1A (0.39) | LMNASMN1; SMN2ALDH1A1L3MBTL1GAA |
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 |
|---|---|---|---|---|---|---|---|
| CN-116546974-A | 5-heteroaryl-1H-pyrazol-3-amine derivatives | 住友制药株式会社 | 2023-08-04 | — | — | CN | disclosed |