Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOTUM | Q6P988 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | NPC1 | O15118 | 2/20 | 0.32 |
| ▸ | RAB9A | P51151 | 2/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.31 |
| ▸ | SLC6A9 | P48067 | 2/20 | 0.31 |
| ▸ | MAPK7 | Q13164 | 1/20 | 0.31 |
| ▸ | GPR142 | Q7Z601 | 1/20 | 0.31 |
| ▸ | PSEN1 | P49768 | 1/20 | 0.30 |
| ▸ | PSEN2 | P49810 | 1/20 | 0.30 |
| ▸ | APH1B | Q8WW43 | 1/20 | 0.30 |
| ▸ | NCSTN | Q92542 | 1/20 | 0.30 |
| ▸ | APH1A | Q96BI3 | 1/20 | 0.30 |
| ▸ | PSENEN | Q9NZ42 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL18330395 | 0.89 | KDM4E (0.46) | NOTUMKDM4E | |
| SCHEMBL18330398 | 0.80 | PSEN1 (0.33) | NOTUMPSEN1PSEN2APH1BNCSTN | |
| SCHEMBL24786148 | 0.75 | NOTUM (0.40) | NOTUMKDM4EMEN1KMT2ASMN1; SMN2 | |
| SCHEMBL20176167 | 0.73 | KDM4E (0.40) | NOTUMKDM4E | |
| SCHEMBL21004930 | 0.73 | NOTUM (0.41) | NOTUMKDM4E | |
| SCHEMBL15933311 | 0.71 | NOTUM (0.42) | NOTUMKDM4E | |
| SCHEMBL21901788 | 0.70 | LRRK2 (0.37) | KDM4ELRRK2NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL14692532 | 0.69 | KDM4E (0.48) | NOTUMKDM4E | |
| SCHEMBL15933233 | 0.69 | NOTUM (0.39) | NOTUMKDM4EMEN1KMT2ANPC1 | |
| SCHEMBL14692396 | 0.69 | NOTUM (0.59) | NOTUMMEN1KMT2ANPC1RAB9A |
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 |
|---|---|---|---|---|---|---|---|
| EP-3868753-B1 | FACTOR XIA MACROCYCLIC INHIBITORS BEARING A NON-AROMATIC P2' GROUP | BRISTOL MYERS SQUIBB CO (US) | 2022-12-21 | — | — | EP | disclosed |