Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMYD3 | Q9H7B4 | 15/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.32 |
| ▸ | MMP2 | P08253 | 1/20 | 0.32 |
| ▸ | MMP8 | P22894 | 1/20 | 0.32 |
| ▸ | GABRR1 | P24046 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL3759316 | 1.00 | SMYD3 (0.39) | SMYD3POLBEPHX2PKMMMP2 | |
| SCHEMBL2697872 | 1.00 | SMYD3 (0.39) | SMYD3POLBEPHX2PKMMMP2 | |
| SCHEMBL18987658 | 1.00 | SMYD3 (0.39) | SMYD3POLBEPHX2PKMMMP2 | |
| SCHEMBL2697870 | 1.00 | SMYD3 (0.39) | SMYD3POLBEPHX2PKMMMP2 | |
| SCHEMBL4196561 | 1.00 | SMYD3 (0.39) | SMYD3POLBEPHX2PKMMMP2 | |
| SCHEMBL2722459 | 1.00 | SMYD3 (0.39) | SMYD3POLBEPHX2PKMMMP2 | |
| SCHEMBL4930315 | 1.00 | SMYD3 (0.39) | SMYD3POLBEPHX2PKMMMP2 | |
| Hydrochloric Acid SCHEMBL10002329 | 0.98 | SMYD3 (0.38) | SMYD3POLBEPHX2PKM | |
| Hydrochloric Acid SCHEMBL4924986 | 0.98 | SMYD3 (0.38) | SMYD3POLBEPHX2PKM | |
| Hydrochloric Acid SCHEMBL4924981 | 0.98 | SMYD3 (0.38) | SMYD3POLBEPHX2PKM |
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-117486758-A | Preparation method of (1S, 3S) -3-aminocycloamyl carbamic acid tert-butyl ester | 南京正济医药研究有限公司 | 2024-02-02 | — | — | CN | claimed |
| CN-117486758-A | Preparation method of (1S, 3S) -3-aminocycloamyl carbamic acid tert-butyl ester | 南京正济医药研究有限公司 | 2024-02-02 | — | — | CN | disclosed |