Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 3/20 | 0.40 |
| ▸ | GRM2 | Q14416 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 4/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.38 |
| ▸ | HTT | P42858 | 3/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 2/20 | 0.37 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.37 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.37 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.37 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.37 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.37 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL4681422 | 0.84 | CYP2D6 (0.41) | KCNH2GRM2MEN1KMT2AAKR1B1 | |
| SCHEMBL4682779 | 0.82 | GRM2 (0.44) | KCNH2GRM2MEN1KMT2AAKR1B1 | |
| SCHEMBL4682670 | 0.80 | P2RX7 (0.43) | KCNH2GRM2ALDH1A1RAB9AP2RX7 | |
| SCHEMBL4161790 | 0.76 | MEN1 (0.44) | KCNH2GRM2MEN1KMT2AAKR1B1 | |
| SCHEMBL2891898 | 0.75 | KCNH2 (0.42) | KCNH2GRM2MEN1KMT2AAKR1B1 | |
| SCHEMBL3905975 | 0.75 | KCNH2 (0.46) | KCNH2GRM2MEN1KMT2AAKR1B1 | |
| SCHEMBL4681372 | 0.74 | GRM2 (0.38) | KCNH2GRM2MEN1KMT2AHTT | |
| SCHEMBL14129855 | 0.73 | KCNH2 (0.39) | KCNH2GRM2MEN1KMT2AAKR1B1 | |
| SCHEMBL4687652 | 0.72 | MAOB (0.39) | KCNH2GRM2SMN1; SMN2L3MBTL1HTT | |
| Hydrochloric Acid SCHEMBL4324964 | 0.72 | KCNH2 (0.38) | KCNH2GRM2MEN1KMT2AAKR1B1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1973906-A1 | HYDROXYDIHYDROPYRIDOPY RAZINE-1,8-DIONES AND METHODS FOR INHIBITING HIV INTEGRASE | Virochem Pharma Inc. (CA) | 2008-10-01 | — | — | EP | disclosed |
| WO-2006066414-A1 | HYDROXYDIHYDROPYRIDOPY RAZINE-1,8-DIONES AND METHODS FOR INHIBITING HIV INTEGRASE | VIROCHEM PHARMA INC. (CA) | 2006-06-29 | — | — | WO | disclosed |