Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 1/20 | 0.38 |
| ▸ | CCNE1 | P24864 | 4/20 | 0.37 |
| ▸ | CDK2 | P24941 | 4/20 | 0.37 |
| ▸ | GSK3B | P49841 | 4/20 | 0.37 |
| ▸ | GSK3A | P49840 | 3/20 | 0.37 |
| ▸ | PTGES | O14684 | 1/20 | 0.37 |
| ▸ | CCNB2 | O95067 | 4/20 | 0.36 |
| ▸ | CDK1 | P06493 | 4/20 | 0.36 |
| ▸ | CCNB1 | P14635 | 4/20 | 0.36 |
| ▸ | CCNB3 | Q8WWL7 | 4/20 | 0.36 |
| ▸ | CCNE2 | O96020 | 3/20 | 0.36 |
| ▸ | CDK4 | P11802 | 2/20 | 0.36 |
| ▸ | CCND1 | P24385 | 2/20 | 0.36 |
| ▸ | HAVCR2 | Q8TDQ0 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 3/20 | 0.33 |
| ▸ | P2RY4 | P51582 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL14022287 | 0.80 | MAOA (0.47) | MAOACCNE1CDK2GSK3BGSK3A | |
| SCHEMBL14023046 | 0.75 | MAOA (0.47) | MAOACCNE1CDK2GSK3BGSK3A | |
| SCHEMBL14355332 | 0.69 | MAOA (0.61) | MAOALMNAHPGDMAPTKDM4E | |
| SCHEMBL14355331 | 0.68 | MAOA (0.60) | MAOALMNAHPGDMAPTP2RY4 | |
| SCHEMBL14088099 | 0.68 | MAOA (0.55) | MAOALMNAHPGDKDM4EALDH1A1 | |
| SCHEMBL17034542 | 0.68 | MAOA (0.55) | MAOACCNE1CDK2GSK3BGSK3A | |
| SCHEMBL14380237 | 0.67 | MAOA (0.49) | MAOALMNAHPGDMAPTKDM4E | |
| SCHEMBL14355334 | 0.66 | MAOA (0.47) | MAOALMNAHPGDP2RY4KDM4E | |
| SCHEMBL14031020 | 0.65 | PARP14 (0.58) | MAOARXFP1MEN1CYP1A2TSHR | |
| SCHEMBL13658590 | 0.65 | KMT2A (0.50) | MAOALMNAHPGDMAPTALDH1A1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2008138773-A2 | VAT DYES OF THE TRIS-ANTHRAQUINONYL-AMINOTRIAZINE SERIES | DYSTAR TEXTILFARBEN GMBH & CO DEUTSCHLAND KG (DE) | 2008-11-20 | — | — | WO | disclosed |