Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 1/20 | 0.55 |
| ▸ | DRD4 | P21917 | 1/20 | 0.55 |
| ▸ | DRD3 | P35462 | 1/20 | 0.55 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | PDIA6 | Q15084 | 1/20 | 0.44 |
| ▸ | CARM1 | Q86X55 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 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 | |
|---|---|---|---|---|
| SCHEMBL14301001 | 0.93 | DRD2 (0.57) | DRD2DRD4DRD3TP53GAA | |
| SCHEMBL7972561 | 0.87 | TP53 (0.61) | DRD2TP53GAAKDM4ESMN1; SMN2 | |
| SCHEMBL18263421 | 0.85 | TP53 (0.58) | DRD2TP53GAAKDM4ESMN1; SMN2 | |
| SCHEMBL4025477 | 0.84 | KDM4E (0.54) | TP53GAAKDM4ESMN1; SMN2POLB | |
| SCHEMBL19908572 | 0.84 | KDM4E (0.54) | TP53GAAKDM4ESMN1; SMN2POLB | |
| SCHEMBL5673992 | 0.83 | DRD2 (0.57) | DRD2DRD4DRD3TP53GAA | |
| SCHEMBL1246531 | 0.82 | KDM4E (0.56) | KDM4ESMN1; SMN2POLBKMT2AL3MBTL1 | |
| SCHEMBL25454020 | 0.80 | CARM1 (0.51) | TP53GAAKDM4ECARM1KMT2A | |
| SCHEMBL25454019 | 0.80 | CARM1 (0.51) | TP53GAAKDM4ECARM1KMT2A | |
| SCHEMBL18263445 | 0.79 | SMN1; SMN2 (0.58) | DRD2TP53GAAKDM4ESMN1; SMN2 |
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-2021202600-A1 | SMALL MOLECULE INHIBITORS OF INFLUENZA HEMAGGLUTININ | THE SCRIPPS RESEARCH INSTITUTE (US) | 2021-10-07 | — | — | WO | disclosed |