Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.39 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.39 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.39 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.39 |
| ▸ | PLG | P00747 | 3/20 | 0.38 |
| ▸ | KLK1 | P06870 | 3/20 | 0.38 |
| ▸ | KLK6 | Q92876 | 3/20 | 0.38 |
| ▸ | LOXL2 | Q9Y4K0 | 2/20 | 0.38 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.36 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.36 |
| ▸ | KLKB1 | P03952 | 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 | |
|---|---|---|---|---|
| SCHEMBL507659 | 0.83 | CSNK2A1 (0.40) | NR1H4LOXL2KLKB1 | |
| SCHEMBL507089 | 0.83 | LOXL2 (0.43) | NR1H4LOXL2 | |
| SCHEMBL12933288 | 0.80 | HSD11B1 (0.50) | — | |
| SCHEMBL1146167 | 0.78 | NR1H4 (0.50) | NR1H4HDAC3HDAC6NCOR2PLG | |
| SCHEMBL6224042 | 0.78 | MKNK1 (0.44) | HDAC3HDAC6NCOR2PLGKLK1 | |
| SCHEMBL506919 | 0.78 | HDAC3 (0.53) | HDAC3HDAC6NCOR2LOXL2 | |
| SCHEMBL8246361 | 0.76 | LOXL2 (0.44) | NR1H4PLGKLK1KLK6LOXL2 | |
| Hydrochloric Acid SCHEMBL479729 | 0.76 | NR1H4 (0.49) | NR1H4PLGKLK1KLK6LOXL2 | |
| SCHEMBL3174714 | 0.73 | LOXL2 (0.61) | HDAC3HDAC6NCOR2PLGKLK1 | |
| Hydrochloric Acid SCHEMBL12499723 | 0.72 | LOXL2 (0.59) | PLGKLK1KLK6LOXL2KLKB1 |
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-2006128184-A2 | PYRIMIDINE OR TRIAZINE FUSED BICYCLIC METALLOPROTEASE INHIBITORS | ALANTOS-PHARMACEUTICALS, INC. (US) | 2006-11-30 | — | — | WO | disclosed |