Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 5/20 | 0.39 |
| ▸ | CA2 | P00918 | 5/20 | 0.39 |
| ▸ | CA9 | Q16790 | 4/20 | 0.39 |
| ▸ | CA6 | P23280 | 3/20 | 0.39 |
| ▸ | CA5A | P35218 | 3/20 | 0.39 |
| ▸ | CA4 | P22748 | 2/20 | 0.39 |
| ▸ | CA12 | O43570 | 2/20 | 0.39 |
| ▸ | CA7 | P43166 | 2/20 | 0.39 |
| ▸ | CA5B | Q9Y2D0 | 2/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.39 |
| ▸ | PTGES2 | Q9H7Z7 | 1/20 | 0.38 |
| ▸ | MMP1 | P03956 | 1/20 | 0.36 |
| ▸ | MMP2 | P08253 | 1/20 | 0.36 |
| ▸ | MMP9 | P14780 | 1/20 | 0.36 |
| ▸ | MMP8 | P22894 | 1/20 | 0.36 |
| ▸ | MMP12 | P39900 | 1/20 | 0.36 |
| ▸ | MMP13 | P45452 | 1/20 | 0.36 |
| ▸ | MMP14 | P50281 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL1694075 | 0.85 | CDK2 (0.41) | CA1CA2CA9CA6CA5A | |
| SCHEMBL5016541 | 0.78 | CA12 (0.48) | CA1CA2CA9CA6CA5A | |
| Hydrochloric Acid SCHEMBL4004125 | 0.76 | CA12 (0.46) | CA1CA2CA9CA6CA5A | |
| SCHEMBL11128864 | 0.76 | TTR (0.44) | GAA | |
| SCHEMBL10650374 | 0.75 | MMP2 (0.40) | GAACA1CA2CA9CA6 | |
| SCHEMBL6680955 | 0.75 | GAA (0.46) | GAACA1CA2CA9CA12 | |
| SCHEMBL30232517 | 0.75 | CA2 (0.50) | CA1CA2CA9CA6CA5A | |
| SCHEMBL10566216 | 0.75 | CA2 (0.50) | CA1CA2CA9CA6CA5A | |
| SCHEMBL14008998 | 0.72 | CYP1A2 (0.38) | GAACA1CA2CA9CA12 | |
| SCHEMBL14519930 | 0.71 | HSD11B1 (0.39) | MMP1MMP2MMP9MMP8MMP12 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7442780-B2 | light fastness, wet and dry crock resistance, perspiration, dye-transfer staining and wash fastness | NORTH CAROLINA STATE UNIVERSITY (US) | 2008-10-28 | — | — | US | disclosed |
| US-20040204571-A1 | Reactive dye compounds | NORTH CAROLINA STATE UNIVERSITY | 2004-10-14 | — | — | US | disclosed |
| EP-1442084-A2 | REACTIVE DYE COMPOUNDS | North Carolina State University (US) | 2004-08-04 | — | — | EP | disclosed |
| WO-2002096995-A2 | REACTIVE DYE COMPOUNDS | NORTH CAROLINA STATE UNIVERSITY (US) | 2002-12-05 | — | — | WO | disclosed |