Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 2/20 | 0.60 |
| ▸ | DRD2 | P14416 | 8/20 | 0.47 |
| ▸ | KDM1A | O60341 | 3/20 | 0.44 |
| ▸ | BCHE | P06276 | 2/20 | 0.44 |
| ▸ | CAMK2D | Q13557 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | PRNP | P04156 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.40 |
| ▸ | HTR1A | P08908 | 1/20 | 0.40 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | DRD1 | P21728 | 1/20 | 0.40 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL19745686 | 0.84 | PTGS2 (0.56) | PTGS2KDM1ABCHEPOLBKDM4E | |
| SCHEMBL21196617 | 0.83 | NR1H2 (0.51) | — | |
| SCHEMBL19747650 | 0.83 | NR1H2 (0.45) | PTGS2CAMK2D | |
| SCHEMBL21196724 | 0.81 | NR1H2 (0.52) | — | |
| SCHEMBL19744451 | 0.81 | NR1H2 (0.46) | PTGS2DRD2 | |
| SCHEMBL31104445 | 0.75 | DRD2 (0.62) | PTGS2DRD2KDM1AKDM4ETP53 | |
| SCHEMBL17419212 | 0.75 | KDM1A (0.58) | DRD2KDM1AKDM4ETP53LMNA | |
| SCHEMBL30981802 | 0.74 | DRD2 (0.44) | DRD2CAMK2DKDM4EMAPK1LMNA | |
| SCHEMBL21214132 | 0.74 | NR1H2 (0.51) | — | |
| SCHEMBL23922712 | 0.73 | NR1H2 (0.45) | PTGS2 |
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-3475277-B1 | ANTI-INFECTIVE HETEROCYCLIC COMPOUNDS AND USES THEREOF | BIOIMICS AB (SE) | 2021-10-20 | — | — | EP | disclosed |