Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTRC | Q99895 | 1/20 | 0.37 |
| ▸ | EDNRB | P24530 | 5/20 | 0.36 |
| ▸ | EDNRA | P25101 | 5/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | RECQL | P46063 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 2/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | GAA | P10253 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | ELANE | P08246 | 1/20 | 0.33 |
| ▸ | CTSG | P08311 | 1/20 | 0.33 |
| ▸ | TYR | P14679 | 1/20 | 0.33 |
| ▸ | PDE4A | P27815 | 1/20 | 0.32 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.32 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.32 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.32 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.32 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.32 |
| ▸ | AKT1 | P31749 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL1164460 | 0.84 | CA2 (0.47) | CTRCEDNRBEDNRALMNARECQL | |
| SCHEMBL21963283 | 0.83 | NPSR1 (0.30) | — | |
| SCHEMBL10885737 | 0.83 | EDNRB (0.36) | CTRCEDNRBEDNRALMNARECQL | |
| SCHEMBL4765907 | 0.79 | CA2 (0.49) | CA2SMN1; SMN2ELANECTSGTYR | |
| SCHEMBL9663893 | 0.78 | EDNRB (0.31) | EDNRBEDNRA | |
| SCHEMBL31510837 | 0.77 | GPR35 (0.43) | ELANECTSGTYR | |
| SCHEMBL7260194 | 0.76 | EDNRB (0.38) | EDNRBEDNRALMNARECQLSMN1; SMN2 | |
| SCHEMBL6956367 | 0.75 | LTB4R (0.38) | EDNRBEDNRALMNACA2ALDH1A1 | |
| SCHEMBL10462693 | 0.74 | — | — | |
| SCHEMBL12261107 | 0.74 | NPSR1 (0.33) | — |
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-104140421-A | Benzisothiazole compound and application thereof in preparation of drug for resisting schizophrenia | SHANGHAI INST PHARM INDUSTRY | 2014-11-12 | — | — | CN | disclosed |
| CN-1064965-C | Novel sulfonamides compound and its use as medicine | HOFFMANN LA ROCHE (CH) | 2001-04-25 | — | — | CN | disclosed |
| CN-1132751-A | Novel sulfonamides compound and its use as medicine | HOFFMANN LA ROCHE (CH) | 1996-10-09 | — | — | CN | disclosed |