Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | CNR2 | P34972 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.35 |
| ▸ | CDC25B | P30305 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 3/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | CDC25A | P30304 | 1/20 | 0.34 |
| ▸ | CDC25C | P30307 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | USP2 | O75604 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL23837375 | 0.90 | MTNR1A (0.32) | — | |
| SCHEMBL23837541 | 0.88 | TSHR (0.34) | TSHRNPSR1TDP1CNR2L3MBTL1 | |
| SCHEMBL17337417 | 0.86 | TSHR (0.40) | TSHRNPSR1TP53HTTTDP1 | |
| SCHEMBL17337416 | 0.86 | TSHR (0.40) | TSHRNPSR1TP53HTTTDP1 | |
| SCHEMBL23837326 | 0.85 | TSHR (0.33) | TSHRNPSR1TDP1CNR2L3MBTL1 | |
| SCHEMBL23837335 | 0.84 | CA1 (0.33) | TSHRNPSR1TP53TDP1CNR2 | |
| SCHEMBL23130193 | 0.84 | TSHR (0.42) | TSHRNPSR1CNR2L3MBTL1CDC25B | |
| SCHEMBL23837341 | 0.83 | TSHR (0.32) | TSHRNPSR1TP53TDP1CNR2 | |
| SCHEMBL23837436 | 0.83 | TSHR (0.35) | TSHRNPSR1TP53TDP1CNR2 | |
| SCHEMBL23837380 | 0.83 | HPGD (0.35) | NPSR1TP53HTTL3MBTL1CDC25B |
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-3882252-A1 | BETA-LACTAMASE INHIBITORS | Venatorx Pharmaceuticals, Inc. (US) | 2021-09-22 | — | — | EP | disclosed |