Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOTUM | Q6P988 | 1/20 | 0.49 |
| ▸ | KDM5B | Q9UGL1 | 1/20 | 0.44 |
| ▸ | RXRA | P19793 | 2/20 | 0.43 |
| ▸ | GRIN1 | Q05586 | 2/20 | 0.43 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.43 |
| ▸ | USP1 | O94782 | 4/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.42 |
| ▸ | KAT6A | Q92794 | 1/20 | 0.42 |
| ▸ | TRPV3 | Q8NET8 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | MET | P08581 | 1/20 | 0.41 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.40 |
| ▸ | SOS1 | Q07889 | 1/20 | 0.39 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.39 |
| ▸ | MGLL | Q99685 | 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 | |
|---|---|---|---|---|
| SCHEMBL12891749 | 0.88 | KDM5B (0.47) | NOTUMKDM5BUSP1KAT6ATRPV3 | |
| SCHEMBL22380050 | 0.83 | NOTUM (0.46) | NOTUMKDM5BKDM4EALDH1A1MAPK1 | |
| SCHEMBL3103821 | 0.80 | NOTUM (0.58) | NOTUMKDM5BRXRAGRIN1GRIN2B | |
| SCHEMBL14350201 | 0.79 | NOTUM (0.46) | NOTUMKDM5BKDM4EALDH1A1MAPK1 | |
| SCHEMBL7027887 | 0.79 | NOTUM (0.49) | NOTUMKDM5BKCNH2KAT6AKDM4E | |
| SCHEMBL8202120 | 0.79 | NOTUM (0.53) | NOTUMRXRAGRIN1GRIN2BKCNH2 | |
| SCHEMBL14199941 | 0.78 | NOTUM (0.53) | NOTUMKDM5BUSP1KDM4EALDH1A1 | |
| SCHEMBL22214068 | 0.78 | LMNA (0.46) | NOTUMKDM5BKCNH2KDM4EALDH1A1 | |
| SCHEMBL24012831 | 0.78 | NOTUM (0.41) | NOTUMUSP1TRPV3KDM4EALDH1A1 | |
| SCHEMBL21736786 | 0.76 | KDM5B (0.46) | NOTUMKDM5BUSP1KAT6ATRPV3 |
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-2017023905-A1 | HETEROCYCLIC COMPOUNDS USEFUL AS MODULATORS OF TNF ALPHA | BRISTOL-MYERS SQUIBB COMPANY (US) | 2017-02-09 | — | — | WO | disclosed |