Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | KDM6B | O15054 | 1/20 | 0.38 |
| ▸ | KDM4A | O75164 | 1/20 | 0.38 |
| ▸ | KDM4D | Q6B0I6 | 1/20 | 0.38 |
| ▸ | HIF1AN | Q9NWT6 | 1/20 | 0.38 |
| ▸ | KDM5B | Q9UGL1 | 1/20 | 0.38 |
| ▸ | KDM2A | Q9Y2K7 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | CXCR2 | P25025 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 3/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | DAO | P14920 | 2/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 3/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.35 |
| ▸ | NPC1 | O15118 | 2/20 | 0.35 |
| ▸ | PKM | P14618 | 2/20 | 0.35 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL30967342 | 0.91 | MAPT (0.36) | ALDH1A1CYP2C9KDM6BKDM4AKDM4D | |
| SCHEMBL30967352 | 0.86 | SMN1; SMN2 (0.45) | ALDH1A1CYP2C9MAPTHPGDLMNA | |
| SCHEMBL30713203 | 0.85 | ALDH1A1 (0.39) | ALDH1A1CYP2C9KDM6BKDM4AKDM4D | |
| SCHEMBL29267236 | 0.85 | EGLN1 (0.39) | ALDH1A1CYP2C9KDM6BKDM4AKDM4D | |
| SCHEMBL31258741 | 0.74 | EPHB3 (0.38) | ALDH1A1MAPTPOLBRAB9ANPC1 | |
| Lithium Ion SCHEMBL31049392 | 0.74 | PTGDR2 (0.35) | ALDH1A1CYP2C9KDM6BKDM4AKDM4D | |
| SCHEMBL30713258 | 0.74 | HTT (0.37) | ALDH1A1MAPTCXCR2LMNAPOLB | |
| SCHEMBL17437979 | 0.74 | KDM4E (0.35) | ALDH1A1HPGDEGLN1KDM4E | |
| SCHEMBL31049474 | 0.74 | CXCR2 (0.38) | ALDH1A1MAPTCXCR2LMNAPOLB | |
| SCHEMBL30967346 | 0.73 | MEN1 (0.32) | MAPTSCN9A |
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-118459452-B | PolyADP ribose hydrolase inhibitor and application thereof | 苏州国匡医药科技有限公司 | 2024-10-25 | — | — | CN | disclosed |
| CN-118459452-A | PolyADP ribose hydrolase inhibitor and application thereof | 苏州国匡医药科技有限公司 | 2024-08-09 | — | — | CN | disclosed |