Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 1/20 | 0.43 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 3/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | PSMB8 | P28062 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | BCL2 | P10415 | 4/20 | 0.39 |
| ▸ | BECN1 | Q14457 | 2/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | CRHBP | P24387 | 1/20 | 0.39 |
| ▸ | FNTA | P49354 | 1/20 | 0.39 |
| ▸ | FNTB | P49356 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL29130759 | 0.89 | MEN1 (0.47) | POLBHPGDSMN1; SMN2KDM4EMEN1 | |
| SCHEMBL490474 | 0.84 | SMN1; SMN2 (0.48) | AKR1C3AKR1C2POLBSMN1; SMN2MEN1 | |
| SCHEMBL31483499 | 0.82 | ALDH1A1 (0.52) | HPGDSMN1; SMN2MEN1KMT2APSMB8 | |
| SCHEMBL4743512 | 0.81 | HPGD (0.41) | POLBHPGDSMN1; SMN2KDM4EMEN1 | |
| SCHEMBL47045 | 0.79 | AKR1C3 (0.47) | AKR1C3AKR1C2POLBKDM4EALDH1A1 | |
| SCHEMBL4740981 | 0.77 | MEN1 (0.54) | AKR1C3AKR1C2POLBSMN1; SMN2MEN1 | |
| SCHEMBL31483503 | 0.77 | ESR1 (0.50) | PSMB8BCL2BECN1TDP1CYP17A1 | |
| SCHEMBL27110752 | 0.77 | ESR1 (0.50) | PSMB8BCL2BECN1TDP1CYP17A1 | |
| SCHEMBL467281 | 0.77 | KMT2A (0.56) | POLBHPGDSMN1; SMN2MEN1KMT2A | |
| SCHEMBL29131710 | 0.77 | HPGD (0.59) | POLBHPGDSMN1; SMN2MAPTPSMB8 |
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-117304180-A | Heterocyclic compound, pharmaceutical composition containing heterocyclic compound, and preparation method and application of heterocyclic compound | 百极弘烨(南通)医药科技有限公司 | 2023-12-29 | — | — | CN | disclosed |