Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 4/20 | 0.41 |
| ▸ | ACHE | P22303 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | MMP13 | P45452 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | RPS6KA2 | Q15349 | 2/20 | 0.35 |
| ▸ | HDAC7 | Q8WUI4 | 2/20 | 0.34 |
| ▸ | GRM5 | P41594 | 2/20 | 0.34 |
| ▸ | CA12 | O43570 | 3/20 | 0.33 |
| ▸ | CA1 | P00915 | 3/20 | 0.33 |
| ▸ | CA4 | P22748 | 2/20 | 0.33 |
| ▸ | CA7 | P43166 | 2/20 | 0.33 |
| ▸ | CA2 | P00918 | 2/20 | 0.33 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.33 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL5781469 | 0.92 | HDAC1 (0.40) | HDAC1ACHEMEN1KMT2AKDM4E | |
| SCHEMBL5781611 | 0.92 | HDAC1 (0.39) | HDAC1ACHEMEN1KMT2AKDM4E | |
| SCHEMBL5781841 | 0.91 | HDAC1 (0.43) | HDAC1ACHEMEN1KMT2AKDM4E | |
| SCHEMBL5782866 | 0.89 | HDAC1 (0.40) | HDAC1ACHEMEN1KMT2AKDM4E | |
| SCHEMBL5780762 | 0.89 | HDAC1 (0.43) | HDAC1ACHEMEN1KMT2AKDM4E | |
| SCHEMBL5783534 | 0.88 | HDAC1 (0.40) | HDAC1ACHEMEN1KMT2AKDM4E | |
| Trifluoroacetic Acid SCHEMBL5781936 | 0.87 | ACHE (0.38) | HDAC1ACHEMEN1KMT2AKDM4E | |
| SCHEMBL5779832 | 0.86 | MAPT (0.43) | HDAC1ACHEMEN1KMT2AKDM4E | |
| SCHEMBL5779462 | 0.86 | MAPT (0.41) | HDAC1ACHEMEN1KMT2AKDM4E | |
| SCHEMBL5781955 | 0.85 | ACHE (0.41) | HDAC1ACHEMEN1KMT2AKDM4E |
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 |
|---|---|---|---|---|---|---|---|
| EP-1408962-B1 | SUBSTITUTED ISOINDOLES AND THE USE THEREOF | BAYER HEALTHCARE AG (DE) | 2006-03-15 | — | — | EP | disclosed |
| EP-1408962-A1 | SUBSTITUTED ISOINDOLES AND THE USE THEREOF | Bayer HealthCare AG (DE) | 2004-04-21 | — | — | EP | disclosed |
| WO-2003007942-A1 | SUBSTITUTED ISOINDOLES AND THE USE THEREOF | BAYER HEALTHCARE AG (DE) | 2003-01-30 | — | — | WO | disclosed |