Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 13/20 | 0.81 |
| ▸ | NPC1 | O15118 | 5/20 | 0.81 |
| ▸ | CCR1 | P32246 | 3/20 | 0.56 |
| ▸ | CCR5 | P51681 | 3/20 | 0.56 |
| ▸ | CCR8 | P51685 | 3/20 | 0.56 |
| ▸ | LMNA | P02545 | 3/20 | 0.56 |
| ▸ | METAP1 | P53582 | 2/20 | 0.56 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.56 |
| ▸ | POLB | P06746 | 1/20 | 0.56 |
| ▸ | BLM | P54132 | 1/20 | 0.56 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.56 |
| ▸ | DOHH | Q9BU89 | 1/20 | 0.56 |
| ▸ | P4HTM | Q9NXG6 | 1/20 | 0.56 |
| ▸ | TP53 | P04637 | 5/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.54 |
| ▸ | HTT | P42858 | 3/20 | 0.54 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.54 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.54 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.54 |
| ▸ | ALPL | P05186 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL7963689 | 0.91 | KDM4E (0.75) | KDM4ENPC1CCR1CCR5CCR8 | |
| SCHEMBL4075083 | 0.90 | KDM4E (1.00) | KDM4ENPC1CCR1CCR5CCR8 | |
| SCHEMBL2061612 | 0.88 | KDM4E (0.70) | KDM4ENPC1CCR1CCR5CCR8 | |
| SCHEMBL7952022 | 0.88 | KDM4E (0.70) | KDM4ENPC1CCR1CCR5CCR8 | |
| SCHEMBL27928516 | 0.88 | KDM4E (0.70) | KDM4ENPC1CCR1CCR5CCR8 | |
| SCHEMBL7952005 | 0.86 | KDM4E (0.68) | KDM4ENPC1CCR1CCR5CCR8 | |
| SCHEMBL323086 | 0.85 | KDM4E (0.68) | KDM4ENPC1CCR1CCR5CCR8 | |
| SCHEMBL14063447 | 0.85 | KDM4E (0.66) | KDM4ENPC1CCR1CCR5CCR8 | |
| SCHEMBL19092285 | 0.83 | KDM4E (0.64) | KDM4ENPC1CCR1CCR5CCR8 | |
| SCHEMBL1104804 | 0.83 | KDM4E (0.74) | KDM4ENPC1METAP1TP53SMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| US-6187928-B1 | TREATING FUNGAL DISEASES | THE ROCKEFELLER UNIVERSITY | 2001-02-13 | — | — | US | disclosed |
| US-6087510-A | Method of use of imidazolium cations | THE ROCKEFELLER UNIVERSITY (US) | 2000-07-11 | — | — | US | disclosed |
| US-5969150-A | FLUORESCENT COMPOUNDS FOR MEDICAL DIAGNOSIS, DRUGS AND LABELS OR FUNGICIDES AND VIRICIDES | THE ROCKEFELLER UNIVERSITY (US) | 1999-10-19 | — | — | US | disclosed |