Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ERN1 | O75460 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | PARP1 | P09874 | 1/20 | 0.33 |
| ▸ | NNMT | P40261 | 1/20 | 0.32 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.32 |
| ▸ | SRC | P12931 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | GLA | P06280 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | CASP1 | P29466 | 1/20 | 0.31 |
| ▸ | CASP7 | P55210 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
| ▸ | CA12 | O43570 | 1/20 | 0.30 |
| ▸ | CA1 | P00915 | 1/20 | 0.30 |
| ▸ | CA2 | P00918 | 1/20 | 0.30 |
| ▸ | CA9 | Q16790 | 1/20 | 0.30 |
| ▸ | ATM | Q13315 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL29285141 | 0.90 | ERN1 (0.39) | ERN1PARP1 | |
| SCHEMBL2361634 | 0.77 | PARP1 (0.33) | KDM4EMAPTPARP1SRCALDH1A1 | |
| SCHEMBL3949652 | 0.75 | KDM4E (0.43) | KDM4EMAPTPARP1NNMTHDAC4 | |
| SCHEMBL4948275 | 0.74 | MAPT (0.38) | KDM4EMAPTPARP1ALDH1A1LMNA | |
| SCHEMBL4947364 | 0.74 | PARP1 (0.36) | KDM4EMAPTPARP1NNMTHDAC4 | |
| SCHEMBL10909321 | 0.74 | ALDH1A1 (0.42) | KDM4EMAPTPARP1HDAC4SRC | |
| SCHEMBL22702928 | 0.74 | KDM4E (0.39) | KDM4EMAPTPARP1SRCALDH1A1 | |
| SCHEMBL10681765 | 0.72 | SRC (0.49) | ERN1KDM4EMAPTPARP1SRC | |
| SCHEMBL29417738 | 0.72 | SRC (0.49) | ERN1KDM4EMAPTPARP1SRC | |
| SCHEMBL30877424 | 0.72 | FABP6 (0.42) | ERN1KDM4EMAPTALDH1A1GLA |
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-117964643-B | Pyrrole [2,3-b ] pyridine derivative and preparation method and application thereof | 苏州朗睿生物医药有限公司 | 2024-07-02 | — | — | CN | disclosed |
| CN-117964643-A | Pyrrole [2,3-b ] pyridine derivative and preparation method and application thereof | 苏州朗睿生物医药有限公司 | 2024-05-03 | — | — | CN | disclosed |