Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CFTR | P13569 | 6/20 | 0.66 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.53 |
| ▸ | GAA | P10253 | 5/20 | 0.53 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.53 |
| ▸ | MAPT | P10636 | 2/20 | 0.53 |
| ▸ | HPGD | P15428 | 2/20 | 0.53 |
| ▸ | GLA | P06280 | 2/20 | 0.53 |
| ▸ | CASP1 | P29466 | 1/20 | 0.53 |
| ▸ | CASP7 | P55210 | 1/20 | 0.53 |
| ▸ | ATM | Q13315 | 1/20 | 0.53 |
| ▸ | ABL1 | P00519 | 1/20 | 0.51 |
| ▸ | TSHR | P16473 | 2/20 | 0.50 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.50 |
| ▸ | NQO2 | P16083 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | CA12 | O43570 | 2/20 | 0.39 |
| ▸ | CA1 | P00915 | 2/20 | 0.39 |
| ▸ | CA2 | P00918 | 2/20 | 0.39 |
| ▸ | CA7 | P43166 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL4758833 | 0.88 | KDM4E (0.73) | CFTRKDM4EALDH1A1GAAHSD17B10 | |
| SCHEMBL14666358 | 0.88 | CFTR (0.53) | CFTRKDM4EALDH1A1GAAHSD17B10 | |
| SCHEMBL24413993 | 0.86 | CFTR (0.58) | CFTRKDM4EALDH1A1GAAHSD17B10 | |
| SCHEMBL12021191 | 0.85 | CFTR (0.62) | CFTRKDM4EALDH1A1GAAHSD17B10 | |
| SCHEMBL16155019 | 0.84 | CFTR (0.65) | CFTRKDM4EALDH1A1GAAHSD17B10 | |
| SCHEMBL24918216 | 0.84 | CFTR (0.60) | CFTRKDM4EALDH1A1GAAHSD17B10 | |
| SCHEMBL857214 | 0.84 | CFTR (0.60) | CFTRKDM4EALDH1A1GAAHSD17B10 | |
| SCHEMBL25405948 | 0.84 | CFTR (0.53) | CFTRKDM4EALDH1A1GAAHSD17B10 | |
| SCHEMBL857614 | 0.84 | KDM4E (0.74) | CFTRKDM4EALDH1A1GAAHSD17B10 | |
| SCHEMBL2391916 | 0.82 | CFTR (0.59) | CFTRKDM4EALDH1A1GAAHSD17B10 |
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-113354590-A | Quinazolinone compound for antagonizing NOD1/2 receptor signal pathway | 宁波康柏睿格医药科技有限公司 | 2021-09-07 | — | — | CN | disclosed |