Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.54 |
| ▸ | LMNA | P02545 | 6/20 | 0.54 |
| ▸ | MAPT | P10636 | 5/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.52 |
| ▸ | L3MBTL1 | Q9Y468 | 4/20 | 0.52 |
| ▸ | HPGD | P15428 | 4/20 | 0.51 |
| ▸ | ATM | Q13315 | 2/20 | 0.51 |
| ▸ | TLR8 | Q9NR97 | 2/20 | 0.51 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.51 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.51 |
| ▸ | KCNN1 | Q92952 | 1/20 | 0.44 |
| ▸ | KCNN2 | Q9H2S1 | 1/20 | 0.44 |
| ▸ | KCNN3 | Q9UGI6 | 1/20 | 0.44 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.42 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.42 |
| ▸ | ADORA2B | P29275 | 2/20 | 0.42 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.42 |
| ▸ | KCNH3 | Q9ULD8 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL22827979 | 0.84 | KDM4E (0.54) | ALDH1A1KDM4ELMNAMAPTSMN1; SMN2 | |
| SCHEMBL22828106 | 0.82 | PTGS2 (0.75) | ALDH1A1KDM4ELMNAMAPTSMN1; SMN2 | |
| SCHEMBL22827975 | 0.81 | TP53 (0.48) | KDM4EMAPTSMN1; SMN2PTGS2ADORA3 | |
| SCHEMBL22828092 | 0.81 | ADORA3 (0.41) | ALDH1A1KDM4ELMNAMAPTSMN1; SMN2 | |
| SCHEMBL22827972 | 0.81 | PTGS2 (0.70) | ALDH1A1LMNASMN1; SMN2PTGS2CYP1A2 | |
| SCHEMBL22827968 | 0.71 | PTGS2 (0.54) | ALDH1A1LMNASMN1; SMN2PTGS2CYP1A2 | |
| SCHEMBL22828090 | 0.70 | PTGS2 (0.72) | ALDH1A1KDM4ELMNAMAPTSMN1; SMN2 | |
| SCHEMBL3451616 | 0.69 | MEN1 (0.46) | ALDH1A1KDM4EMAPTSMN1; SMN2L3MBTL1 | |
| SCHEMBL24334941 | 0.68 | PTGS2 (0.75) | ALDH1A1KDM4ELMNAMAPTSMN1; SMN2 | |
| SCHEMBL3452020 | 0.68 | HSP90AA1 (0.64) | ALDH1A1KDM4EMAPTADORA3ADORA2A |
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-2020257653-A1 | RADIOLABELED COMPOUNDS AND USES THEREOF | THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) | 2020-12-24 | — | — | WO | disclosed |