Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 4/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | GLA | P06280 | 1/20 | 0.41 |
| ▸ | USP2 | O75604 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.40 |
| ▸ | NR5A1 | Q13285 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL8537606 | 0.89 | L3MBTL1 (0.56) | MAPTL3MBTL1POLBKDM4ETSHR | |
| SCHEMBL8482730 | 0.80 | TSHR (0.49) | L3MBTL1POLBUSP2TSHRMAPK1 | |
| SCHEMBL9315956 | 0.78 | ITGB3 (0.40) | KCNH2MAPTL3MBTL1POLBKDM4E | |
| SCHEMBL8537604 | 0.78 | POLB (0.41) | KCNH2MAPTL3MBTL1POLBUSP2 | |
| SCHEMBL8479012 | 0.78 | ESRRG (0.39) | MAPTKDM4EALDH1A1SMN1; SMN2 | |
| SCHEMBL8482310 | 0.78 | ALDH1A1 (0.45) | L3MBTL1POLBKDM4EUSP2ALDH1A1 | |
| SCHEMBL8478983 | 0.77 | ITGB3 (0.36) | MAPTKDM4EALDH1A1SMN1; SMN2 | |
| SCHEMBL5548973 | 0.74 | GPR84 (0.53) | L3MBTL1KDM4EUSP2ALDH1A1 | |
| SCHEMBL8541852 | 0.74 | MAPT (0.61) | MAPTL3MBTL1POLBKDM4EGLA | |
| SCHEMBL20442668 | 0.74 | KDM4E (0.54) | MAPTL3MBTL1POLBKDM4ETSHR |
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-0485045-B1 | Mono-N-substituted 1,4,7,10-Tetraazacyclododecan-derivatives, process for their preparation and pharmaceutical agent containing them | SCHERING AG (DE) | 1998-12-30 | — | — | EP | disclosed |
| US-5277895-A | Nuclear magnetic resonance | SCHERING AKTIENGESELLSCHAFT (DE) | 1994-01-11 | — | — | US | disclosed |
| EP-0485045-A2 | Mono-N-substituted 1,4,7,10-Tetraazacyclododecan-derivatives, process for their preparation and pharmaceutical agent containing them | SCHERING AKTIENGESELLSCHAFT (DE) | 1992-05-13 | — | — | EP | disclosed |