Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
| ▸ | CA9 | Q16790 | 1/20 | 0.37 |
| ▸ | TRPV1 | Q8NER1 | 3/20 | 0.35 |
| ▸ | CCR2 | P41597 | 1/20 | 0.35 |
| ▸ | BACE1 | P56817 | 1/20 | 0.35 |
| ▸ | FAAH | O00519 | 1/20 | 0.35 |
| ▸ | TRPV4 | Q9HBA0 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | NPY2R | P49146 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | KCNQ3 | O43525 | 1/20 | 0.34 |
| ▸ | KCNQ2 | O43526 | 1/20 | 0.34 |
| ▸ | KCNQ4 | P56696 | 1/20 | 0.34 |
| ▸ | KCNQ5 | Q9NR82 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | RORC | P51449 | 1/20 | 0.34 |
| ▸ | UBE2M | P61081 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL19365598 | 0.95 | TSHR (0.36) | KMT2ATSHRCA2CA9TRPV1 | |
| SCHEMBL20632966 | 0.91 | CA2 (0.39) | KMT2ATSHRCA2CA9TRPV1 | |
| SCHEMBL19862439 | 0.90 | KMT2A (0.41) | KMT2ATSHRCA2CA9TRPV1 | |
| SCHEMBL16250002 | 0.89 | KMT2A (0.37) | KMT2ATSHRCA2CA9TRPV1 | |
| SCHEMBL16785514 | 0.89 | KMT2A (0.37) | KMT2ATSHRCA2CA9TRPV1 | |
| SCHEMBL17618888 | 0.87 | NAMPT (0.42) | KMT2ATSHRCA2CA9TRPV4 | |
| SCHEMBL19365864 | 0.87 | KMT2A (0.39) | KMT2ATSHRCA2CA9CCR2 | |
| SCHEMBL19670508 | 0.86 | KMT2A (0.38) | KMT2ATSHRCA2CA9TRPV1 | |
| SCHEMBL17618894 | 0.86 | KMT2A (0.37) | KMT2ATSHRCA2CA9TRPV1 | |
| SCHEMBL16250003 | 0.86 | CA2 (0.42) | KMT2ACA2CA9BACE1NPY2R |
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-9834558-B2 | Substituted bridged urea analogs as sirtuin modulators | GLAXOSMITHKLINE LLC (US) | 2017-12-05 | — | — | US | disclosed |