Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 2/20 | 0.62 |
| ▸ | CA4 | P22748 | 1/20 | 0.62 |
| ▸ | CA5A | P35218 | 1/20 | 0.62 |
| ▸ | GRIK1 | P39086 | 1/20 | 0.57 |
| ▸ | PGK1 | P00558 | 3/20 | 0.52 |
| ▸ | PGK2 | P07205 | 3/20 | 0.52 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.52 |
| ▸ | PTPN5 | P54829 | 1/20 | 0.52 |
| ▸ | FBP1 | P09467 | 1/20 | 0.51 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.50 |
| ▸ | MMP8 | P22894 | 2/20 | 0.49 |
| ▸ | MMP14 | P50281 | 2/20 | 0.49 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.49 |
| ▸ | FDPS | P14324 | 1/20 | 0.49 |
| ▸ | CA9 | Q16790 | 1/20 | 0.49 |
| ▸ | GGPS1 | O95749 | 2/20 | 0.46 |
| ▸ | KMO | O15229 | 1/20 | 0.45 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.45 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.45 |
| ▸ | CFTR | P13569 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL12353499 | 0.93 | GRIK1 (0.62) | CA2CA4CA5AGRIK1PGK1 | |
| Biphenyl SCHEMBL3672357 | 0.86 | CA2 (0.84) | CA2CA4CA5APGK1PGK2 | |
| SCHEMBL3038384 | 0.86 | CA2 (0.56) | CA2CA4CA5AGRIK1PGK1 | |
| SCHEMBL10039221 | 0.84 | HDAC8 (0.50) | CA2CA4CA5AGRIK1PTPN1 | |
| SCHEMBL22634016 | 0.82 | HDAC8 (0.48) | CA2CA4CA5AGRIK1PTPN1 | |
| SCHEMBL11991059 | 0.82 | HDAC8 (0.48) | CA2CA4CA5AGRIK1PTPN1 | |
| SCHEMBL6262029 | 0.81 | CA2 (0.65) | CA2CA4CA5AGRIK1PGK1 | |
| SCHEMBL22999958 | 0.80 | CA2 (0.52) | CA2CA4CA5AGRIK1PGK1 | |
| SCHEMBL13205032 | 0.80 | HDAC8 (0.47) | CA2CA4CA5APTPN1PTPN5 | |
| SCHEMBL22174847 | 0.80 | HDAC8 (0.47) | CA2GRIK1PTPN1PTPN5HDAC8 |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-100556934-C | Proton-conducting polymer membrane comprising polyazoles with phosphonic acid groups and use thereof in fuel cells | PEMEAS GMBH (DE) | 2009-11-04 | — | — | CN | disclosed |
| CN-100423721-C | Thrombopoietin mimetics | SMITHKLINE BEECHAM CORP (US) | 2008-10-08 | — | — | CN | disclosed |
| CN-1726071-A | Proton conducting polymer membrane comprising phoshphonic acid groups containing polyazoles and the use thereof in fuel cells | PEMEAS GMBH (DE) | 2006-01-25 | — | — | CN | disclosed |
| EP-1268494-A1 | SULFUR SUBSTITUTED ARYLDIFLUOROMETHYLPHOSPHONIC ACIDS AS PTP-1B INHIBITORS | Merck Frosst Canada & Co. (CA) | 2003-01-02 | — | — | EP | disclosed |
| EP-1244677-A1 | PHOSPHONIC ACID BIARYL DERIVATIVES AS INHIBITORS OF PROTEIN TYROSINE PHOSPHATASE 1B (PTP-1B) | MERCK FROSST CANADA INC. (CA) | 2002-10-02 | — | — | EP | disclosed |
| WO-2001070753-A1 | SULFUR SUBSTITUTED ARYLDIFLUOROMETHYLPHOSPHONIC ACIDS AS PTP-1B INHIBITORS | MERCK FROSST CANADA & CO. (CA) | 2001-09-27 | — | — | WO | disclosed |
| WO-2001046203-A1 | PHOSPHONIC ACID BIARYL DERIVATIVES AS INHIBITORS OF PROTEIN TYROSINE PHOSPHATASE 1B (PTP-1B) | MERCK FROSST CANADA & CO. (CA) | 2001-06-28 | — | — | WO | disclosed |