Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 3/20 | 0.48 |
| ▸ | NPC1 | O15118 | 3/20 | 0.48 |
| ▸ | TSHR | P16473 | 3/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.48 |
| ▸ | LMNA | P02545 | 2/20 | 0.48 |
| ▸ | HPGD | P15428 | 2/20 | 0.48 |
| ▸ | TP53 | P04637 | 1/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.48 |
| ▸ | HTT | P42858 | 1/20 | 0.48 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.48 |
| ▸ | RELA | Q04206 | 1/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.45 |
| ▸ | ATM | Q13315 | 1/20 | 0.45 |
| ▸ | NPBWR1 | P48145 | 7/20 | 0.45 |
| ▸ | AURKA | O14965 | 1/20 | 0.43 |
| ▸ | GRK2 | P25098 | 1/20 | 0.43 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.43 |
| ▸ | RPS6KA1 | Q15418 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL30095522 | 0.77 | LMNA (0.43) | RAB9ANPC1TSHRSMN1; SMN2LMNA | |
| SCHEMBL28899220 | 0.77 | LMNA (0.43) | RAB9ANPC1TSHRSMN1; SMN2LMNA | |
| SCHEMBL28899162 | 0.76 | NPBWR1 (0.56) | HTTHSD17B10NPBWR1AURKAGRK2 | |
| SCHEMBL28321534 | 0.74 | HDAC3 (0.62) | TSHRTP53POLBHTTMTNR1A | |
| SCHEMBL30579886 | 0.72 | TDP1 (0.64) | RAB9ANPC1HTTHSD17B10NPBWR1 | |
| SCHEMBL28899217 | 0.72 | MAPT (0.52) | SMN1; SMN2NPBWR1AURKAGRK2ROCK1 | |
| SCHEMBL28899175 | 0.70 | MAP3K5 (0.48) | NPBWR1AURKAGRK2ROCK1RPS6KA1 | |
| SCHEMBL28899197 | 0.70 | AURKA (0.43) | NPBWR1AURKAGRK2ROCK1RPS6KA1 | |
| SCHEMBL22226011 | 0.69 | NPBWR1 (0.62) | TP53NPBWR1AURKAGRK2ROCK1 | |
| SCHEMBL25432622 | 0.69 | NPBWR1 (0.55) | NPBWR1PKMPKLRPDE1APDE1B |
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-109456308-B | Heterocyclic compounds as ASK inhibitors and their use | 南京圣和药业股份有限公司 | 2022-11-29 | — | — | CN | disclosed |
| CN-109456308-A | Heterocyclic compound and its application as ASK inhibitor | 南京圣和药业股份有限公司 | 2019-03-12 | — | — | CN | disclosed |