Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 1/20 | 0.38 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.36 |
| ▸ | KMO | O15229 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.35 |
| ▸ | ACMSD | Q8TDX5 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | GLA | P06280 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | PSMB5 | P28074 | 2/20 | 0.33 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.33 |
| ▸ | HDAC2 | Q92769 | 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 | |
|---|---|---|---|---|
| SCHEMBL21079116 | 0.88 | KDM5A (0.37) | BACE1CYP11B2KMOHTTKDM4E | |
| SCHEMBL778084 | 0.75 | CYP11B2 (0.46) | BACE1CYP11B2KMOHTTKMT2A | |
| SCHEMBL20633629 | 0.72 | DHODH (0.34) | BACE1KMODHODH | |
| SCHEMBL778085 | 0.72 | HDAC8 (0.43) | BACE1CYP11B2KMOHTTKMT2A | |
| SCHEMBL15172959 | 0.72 | KMO (0.36) | CYP11B2KMOHTTKMT2ATDP1 | |
| SCHEMBL29957390 | 0.72 | KDM4E (0.38) | HTTKDM4ESMN1; SMN2MAPTEPHX2 | |
| SCHEMBL21986515 | 0.71 | ALDH1A1 (0.38) | KMOHTTKMT2ATDP1ACMSD | |
| SCHEMBL19537423 | 0.68 | BACE1 (0.41) | BACE1CYP11B2HTTKDM4ELMNA | |
| SCHEMBL16573747 | 0.68 | BACE1 (0.41) | BACE1CYP11B2KMOHTTKMT2A | |
| SCHEMBL18003336 | 0.68 | ALDH1A1 (0.36) | SMN1; SMN2L3MBTL1LMNA |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1420019-B1 | Substituted pyridino pentaazamacrocyle ligands | MONSANTO CO (US) | 2007-07-25 | — | — | EP | disclosed |
| EP-1420022-B1 | Use of substituted pyridino pentaazamacrocyle complexes having superoxide dismutase activity | MONSANTO CO (US) | 2007-07-04 | — | — | EP | disclosed |
| EP-1212323-B1 | SUBSTITUTED PYRIDINO PENTAAZAMACROCYLE COMPLEXES HAVING SUPEROXIDE DISMUTASE ACTIVITY | MONSANTO CO (US) | 2004-06-09 | — | — | EP | disclosed |
| EP-1420022-A1 | Substituted pyridino pentaazamacrocyle complexes having superoxide dismutase activity | MONSANTO COMPANY (US) | 2004-05-19 | — | — | EP | disclosed |
| EP-1420019-A1 | Substituted pyridino pentaazamacrocyle ligands having superoxide dismutase activity | MONSANTO COMPANY (US) | 2004-05-19 | — | — | EP | disclosed |
| WO-2001019823-A9 | SUBSTITUTED PYRIDINO PENTAAZAMACROCYLE COMPLEXES HAVING SUPEROXIDE DISMUTASE ACTIVITY | MONSANTO CO (US) | 2002-09-26 | — | — | WO | disclosed |
| EP-1212323-A2 | SUBSTITUTED PYRIDINO PENTAAZAMACROCYLE COMPLEXES HAVING SUPEROXIDE DISMUTASE ACTIVITY | MONSANTO COMPANY (US) | 2002-06-12 | — | — | EP | disclosed |
| US-6214817-B1 | NITROGEN MACROCYCLE COMPLEXES WITH MANGANESE AND IRON | MONSANTO COMPANY | 2001-04-10 | — | — | US | disclosed |
| WO-2001019823-A2 | SUBSTITUTED PYRIDINO PENTAAZAMACROCYLE COMPLEXES HAVING SUPEROXIDE DISMUTASE ACTIVITY | MONSANTO COMPANY (US) | 2001-03-22 | — | — | WO | disclosed |