Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.45 |
| ▸ | NPC1 | O15118 | 2/20 | 0.45 |
| ▸ | RAB9A | P51151 | 2/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 3/20 | 0.39 |
| ▸ | BRD4 | O60885 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 3/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | THRB | P10828 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | NAMPT | P43490 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL29029338 | 0.85 | SMN1; SMN2 (0.48) | SMN1; SMN2NPC1RAB9AKDM4ECYP2C19 | |
| SCHEMBL28871079 | 0.78 | RAB9A (0.44) | SMN1; SMN2NPC1RAB9AKDM4EGAA | |
| SCHEMBL29967324 | 0.78 | RAB9A (0.44) | SMN1; SMN2NPC1RAB9AKDM4EGAA | |
| SCHEMBL24661835 | 0.72 | CYP2C9 (0.44) | KDM4ECYP2C19CYP2C9KMT2AMEN1 | |
| SCHEMBL29195725 | 0.71 | SMN1; SMN2 (0.56) | SMN1; SMN2NPC1RAB9AKDM4ECYP2C19 | |
| SCHEMBL25117833 | 0.71 | KMT2A (0.49) | SMN1; SMN2NPC1RAB9AKDM4ECYP2C19 | |
| SCHEMBL30317187 | 0.71 | KMT2A (0.49) | SMN1; SMN2NPC1RAB9AKDM4ECYP2C19 | |
| SCHEMBL23501601 | 0.69 | CYP2C9 (0.50) | SMN1; SMN2NPC1RAB9AKDM4ECYP2C19 | |
| SCHEMBL31153493 | 0.68 | GPR35 (0.57) | NPC1RAB9ACYP2C19CYP1A2GAA | |
| SCHEMBL31161532 | 0.68 | CYP2C9 (0.47) | NPC1RAB9AKDM4ECYP2C19CYP2C9 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116836161-A | PARP1 inhibitors | 南京圣和药业股份有限公司 | 2023-10-03 | — | — | CN | disclosed |
| CN-116535401-A | Novel PARP1 inhibitors and uses thereof | 南京圣和药业股份有限公司 | 2023-08-04 | — | — | CN | disclosed |
| CN-116143776-A | PARP1 inhibitor and application thereof | 南京圣和药业股份有限公司 | 2023-05-23 | — | — | CN | disclosed |