Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMYD3 | Q9H7B4 | 1/20 | 0.60 |
| ▸ | PARP1 | P09874 | 5/20 | 0.56 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | CREBBP | Q92793 | 2/20 | 0.39 |
| ▸ | BRD4 | O60885 | 1/20 | 0.39 |
| ▸ | SCN5A | Q14524 | 2/20 | 0.39 |
| ▸ | SCN9A | Q15858 | 2/20 | 0.39 |
| ▸ | AURKA | O14965 | 1/20 | 0.39 |
| ▸ | RAF1 | P04049 | 1/20 | 0.38 |
| ▸ | BRAF | P15056 | 1/20 | 0.38 |
| ▸ | HTR1A | P08908 | 1/20 | 0.38 |
| ▸ | DRD2 | P14416 | 1/20 | 0.38 |
| ▸ | SCN1A | P35498 | 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL7373686 | 0.98 | SMYD3 (0.58) | SMYD3PARP1GAAKMT2ACREBBP | |
| SCHEMBL31364686 | 0.86 | SMYD3 (0.57) | SMYD3PARP1GAAKMT2ACREBBP | |
| SCHEMBL306669 | 0.86 | SMYD3 (0.57) | SMYD3PARP1GAAKMT2ACREBBP | |
| SCHEMBL17476309 | 0.84 | SMYD3 (0.56) | SMYD3PARP1GAAKMT2ACREBBP | |
| SCHEMBL29753562 | 0.81 | SMYD3 (0.56) | SMYD3GAAKMT2ACREBBPBRD4 | |
| SCHEMBL1340605 | 0.81 | SMYD3 (0.56) | SMYD3GAAKMT2ACREBBPBRD4 | |
| SCHEMBL17476304 | 0.81 | SMYD3 (0.56) | SMYD3GAAKMT2ACREBBPBRD4 | |
| SCHEMBL6181892 | 0.77 | SMYD3 (0.50) | SMYD3PARP1GAACREBBPBRD4 | |
| SCHEMBL4317646 | 0.77 | SMYD3 (0.51) | SMYD3PARP1GAACREBBPBRD4 | |
| SCHEMBL254031 | 0.77 | SMYD3 (0.48) | SMYD3PARP1KMT2ACREBBPBRD4 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1262548-C | Synthesis of benzoxazine monohydrochlorate compound | XINYI WANXIANG PHARMACEUTICAL (CN) | 2006-07-05 | — | — | CN | disclosed |
| CN-1552699-A | Synthesis of benzoxazine monohydrochlorate compound | 上海延安万象药业股份有限公司 | 2004-12-08 | — | — | CN | disclosed |
| EP-0407137-B1 | Benzazine compounds and pharmaceutical uses thereof | YOSHITOMI PHARMACEUTICAL (JP) | 1996-05-01 | — | — | EP | disclosed |
| US-5185333-A | Dopamine D2 receptor blocking agents | YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) | 1993-02-09 | — | — | US | disclosed |
| EP-0407137-A2 | Benzazine compounds and pharmaceutical uses thereof | YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) | 1991-01-09 | — | — | EP | disclosed |