Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHEK1 | O14757 | 3/20 | 0.47 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.36 |
| ▸ | TNF | P01375 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.33 |
| ▸ | CD274 | Q9NZQ7 | 2/20 | 0.32 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | PDCD1LG2 | Q9BQ51 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.31 |
| ▸ | BCHE | P06276 | 1/20 | 0.31 |
| ▸ | ACHE | P22303 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL29045170 | 0.83 | CHEK1 (0.47) | CHEK1KCNH2HSD17B10GAADYRK1A | |
| SCHEMBL24945078 | 0.82 | KCNH2 (0.51) | CHEK1KCNH2 | |
| SCHEMBL30522689 | 0.82 | KCNH2 (0.51) | CHEK1KCNH2 | |
| SCHEMBL29045191 | 0.76 | CD274 (0.34) | CHEK1KCNH2TNFGAACD274 | |
| SCHEMBL29045179 | 0.71 | CHEK1 (0.35) | CHEK1KCNH2HSD17B10TNFCD274 | |
| SCHEMBL24936161 | 0.68 | KCNH2 (0.66) | CHEK1KCNH2DYRK1A | |
| SCHEMBL24485104 | 0.68 | STK17B (0.48) | KCNH2 | |
| SCHEMBL30522667 | 0.68 | KCNH2 (0.66) | CHEK1KCNH2DYRK1A | |
| SCHEMBL24936150 | 0.64 | KCNH2 (0.57) | CHEK1KCNH2DYRK1A | |
| SCHEMBL24945515 | 0.64 | KCNH2 (0.49) | CHEK1KCNH2NPSR1 |
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 |