Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 3/20 | 0.38 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.35 |
| ▸ | RECQL | P46063 | 1/20 | 0.34 |
| ▸ | MGLL | Q99685 | 2/20 | 0.34 |
| ▸ | LOX | P28300 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL9039729 | 0.89 | PTGS2 (0.43) | POLBCA2NLRP3KDM4EPTGS2 | |
| SCHEMBL12821019 | 0.81 | POLB (0.58) | POLBCA2SMN1; SMN2KDM4ETSHR | |
| SCHEMBL692151 | 0.79 | S1PR1 (0.41) | CA2SMN1; SMN2KDM4EMGLLMEN1 | |
| SCHEMBL18542695 | 0.79 | ALDH1A1 (0.50) | POLBCA2SMN1; SMN2MEN1KMT2A | |
| SCHEMBL11105370 | 0.79 | RECQL (0.57) | CA2SMN1; SMN2RECQLTSHR | |
| SCHEMBL28311456 | 0.78 | CA2 (0.39) | POLBCA2SMN1; SMN2PTGS2RECQL | |
| SCHEMBL1903867 | 0.78 | KMT2A (0.54) | SMN1; SMN2TSHRMEN1KMT2A | |
| SCHEMBL12741535 | 0.78 | TAAR1 (0.44) | MEN1KMT2A | |
| SCHEMBL11803736 | 0.77 | MAOA (0.40) | KDM4EPTGS2 | |
| SCHEMBL9154134 | 0.76 | MGLL (0.43) | CA2KDM4EMGLLMEN1KMT2A |
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-5614562-A | Method of treating drug resistant tumor cells using organoselenones | THE UNIVERSITY OF SOURTHERN CALIFORNIA (US) | 1997-03-25 | — | — | US | disclosed |