Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | KCNJ1 | P48048 | 5/20 | 0.37 |
| ▸ | KCNH2 | Q12809 | 4/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | NR2F2 | P24468 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | DPP4 | P27487 | 1/20 | 0.36 |
| ▸ | DPP7 | Q9UHL4 | 1/20 | 0.36 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.36 |
| ▸ | RECQL | P46063 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL463473 | 0.93 | LMNA (0.44) | LMNAKCNJ1KCNH2KDM4ESMN1; SMN2 | |
| SCHEMBL409694 | 0.88 | ALDH1A1 (0.43) | LMNAKCNJ1KCNH2KDM4ESMN1; SMN2 | |
| SCHEMBL18021179 | 0.83 | SIGMAR1 (0.40) | LMNAKCNJ1KCNH2SMN1; SMN2OPRK1 | |
| SCHEMBL13062232 | 0.81 | LMNA (0.47) | LMNAKCNJ1KCNH2KDM4ESMN1; SMN2 | |
| SCHEMBL17986169 | 0.81 | KCNJ1 (0.46) | LMNAKCNJ1KCNH2KDM4ESMN1; SMN2 | |
| SCHEMBL17986126 | 0.81 | KCNJ1 (0.46) | LMNAKCNJ1KCNH2KDM4ESMN1; SMN2 | |
| SCHEMBL18021170 | 0.80 | SIGMAR1 (0.43) | KCNJ1KCNH2KDM4ESMN1; SMN2NPC1 | |
| SCHEMBL16631795 | 0.78 | SIGMAR1 (0.42) | LMNAKCNJ1KCNH2SMN1; SMN2OPRK1 | |
| SCHEMBL13014003 | 0.78 | LMNA (0.41) | LMNASMN1; SMN2POLBALDH1A1MEN1 | |
| SCHEMBL3257334 | 0.78 | ITGB3 (0.36) | KDM4EOPRK1 |
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-2010011367-A2 | BIMODAL LIGANDS WITH MACROCYCLIC AND ACYCLIC BINDING MOIETIES, COMPLEXES AND COMPOSITIONS THEREOF, AND METHODS OF USING | ILLINOIS INSTITUTE OF TECHNOLOGY (US) | 2010-01-28 | — | — | WO | disclosed |