Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.41 |
| ▸ | EPHX1 | P07099 | 3/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.39 |
| ▸ | DPP4 | P27487 | 1/20 | 0.37 |
| ▸ | DPP8 | Q6V1X1 | 1/20 | 0.37 |
| ▸ | DPP9 | Q86TI2 | 1/20 | 0.37 |
| ▸ | DPP7 | Q9UHL4 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | CCR5 | P51681 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL14598858 | 1.00 | SIGMAR1 (0.41) | SIGMAR1EPHX1KCNH2DPP4DPP8 | |
| SCHEMBL25936685 | 1.00 | SIGMAR1 (0.41) | SIGMAR1EPHX1KCNH2DPP4DPP8 | |
| SCHEMBL463655 | 1.00 | SIGMAR1 (0.41) | SIGMAR1EPHX1KCNH2DPP4DPP8 | |
| SCHEMBL14621087 | 1.00 | SIGMAR1 (0.41) | SIGMAR1EPHX1KCNH2DPP4DPP8 | |
| SCHEMBL463616 | 1.00 | SIGMAR1 (0.41) | SIGMAR1EPHX1KCNH2DPP4DPP8 | |
| SCHEMBL6562226 | 0.88 | KCNH2 (0.38) | SIGMAR1EPHX1KCNH2DPP4DPP8 | |
| SCHEMBL6561474 | 0.87 | KCNH2 (0.38) | SIGMAR1EPHX1KCNH2DPP4DPP8 | |
| SCHEMBL406627 | 0.85 | EPHX1 (0.36) | SIGMAR1EPHX1KCNH2DPP4DPP8 | |
| SCHEMBL405661 | 0.85 | EPHX1 (0.36) | SIGMAR1EPHX1KCNH2DPP4DPP8 | |
| SCHEMBL23476594 | 0.85 | EPHX1 (0.34) | EPHX1DPP4DPP8DPP9DPP7 |
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 |
|---|---|---|---|---|---|---|---|
| US-7163935-B2 | Scorpionate-like pendant macrocyclic ligands, complexes and compositions thereof, and methods of using same | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) | 2007-01-16 | — | — | US | disclosed |