Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX5 | P09917 | 2/20 | 0.43 |
| ▸ | PTGES | O14684 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.42 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.42 |
| ▸ | APP | P05067 | 1/20 | 0.41 |
| ▸ | GRM5 | P41594 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | LIMK1 | P53667 | 1/20 | 0.39 |
| ▸ | LIMK2 | P53671 | 1/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.39 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.39 |
| ▸ | RAF1 | P04049 | 1/20 | 0.38 |
| ▸ | MAP2K1 | Q02750 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL18767170 | 0.86 | ALOX5 (0.43) | ALOX5PTGESMEN1KMT2AHPGD | |
| SCHEMBL18767168 | 0.82 | TSHR (0.39) | ALDH1A1HPGDTP53HTTKDM4E | |
| SCHEMBL731278 | 0.81 | MEN1 (0.56) | MEN1KMT2AHPGDGRM5TP53 | |
| SCHEMBL730969 | 0.79 | LMNA (0.59) | ALOX5PTGESMEN1KMT2AALDH1A1 | |
| SCHEMBL30931811 | 0.79 | LMNA (0.59) | ALOX5PTGESMEN1KMT2AALDH1A1 | |
| SCHEMBL18767173 | 0.78 | PTGES (0.39) | ALOX5PTGESMEN1KMT2AADORA3 | |
| SCHEMBL8894460 | 0.75 | ALOX5 (0.63) | ALOX5MEN1KMT2AALDH1A1HDAC1 | |
| SCHEMBL8894465 | 0.72 | MEN1 (0.69) | ALOX5MEN1KMT2AALDH1A1HPGD | |
| SCHEMBL12076214 | 0.72 | MEN1 (0.67) | ALOX5PTGESMEN1KMT2AALDH1A1 | |
| SCHEMBL603696 | 0.71 | NUDT1 (0.48) | ALOX5PTGESALDH1A1GRM5HTT |
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-2017066742-A1 | BACE-2 INHIBITORY COMPOUNDS AND RELATED METHODS OF USE | JORTAN PHARMACEUTICALS INC. (US) | 2017-04-20 | — | — | WO | disclosed |