Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DPP4 | P27487 | 1/20 | 0.36 |
| ▸ | KDM1A | O60341 | 3/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.34 |
| ▸ | KDM1B | Q8NB78 | 1/20 | 0.34 |
| ▸ | ADRB2 | P07550 | 8/20 | 0.34 |
| ▸ | KIF11 | P52732 | 1/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.31 |
| ▸ | RCOR1 | Q9UKL0 | 1/20 | 0.31 |
| ▸ | CFD | P00746 | 1/20 | 0.30 |
| ▸ | TPSB2 | P20231 | 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL22691744 | 0.98 | DPP4 (0.36) | DPP4KDM1AKCNH2KDM1BADRB2 | |
| Hydrochloric Acid SCHEMBL22691747 | 0.98 | DPP4 (0.36) | DPP4KDM1AKCNH2KDM1BADRB2 | |
| SCHEMBL3611762 | 0.86 | ADRB2 (0.40) | DPP4KDM1AKCNH2KDM1BADRB2 | |
| SCHEMBL3611759 | 0.86 | ADRB2 (0.40) | DPP4KDM1AKCNH2KDM1BADRB2 | |
| SCHEMBL12498903 | 0.84 | CES2 (0.40) | DPP4 | |
| SCHEMBL20472544 | 0.84 | CES2 (0.40) | DPP4 | |
| SCHEMBL30722300 | 0.81 | KIF11 (0.36) | DPP4KIF11SLC6A4CYP1A2 | |
| SCHEMBL15496335 | 0.79 | S1PR1 (0.39) | DPP4KCNH2SLC6A4CYP1A2CYP2D6 | |
| SCHEMBL15511854 | 0.79 | S1PR1 (0.39) | DPP4KCNH2SLC6A4CYP1A2CYP2D6 | |
| SCHEMBL12497573 | 0.77 | KIF11 (0.44) | KDM1AKIF11 |
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-2020236688-A1 | NATRIURETIC PEPTIDE RECEPTOR A AGONISTS USEFUL FOR THE TREATMENT OF CARDIOMETABOLIC DISEASES, KIDNEY DISEASE AND DIABETES | MERCK SHARP & DOHME CORP. (US) | 2020-11-26 | — | — | WO | disclosed |