Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE5A | O76074 | 1/20 | 0.63 |
| ▸ | MAPT | P10636 | 11/20 | 0.58 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.58 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.58 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.58 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.58 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.58 |
| ▸ | MEN1 | O00255 | 3/20 | 0.58 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.58 |
| ▸ | LMNA | P02545 | 2/20 | 0.58 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.58 |
| ▸ | HPGD | P15428 | 1/20 | 0.58 |
| ▸ | HTT | P42858 | 1/20 | 0.58 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.57 |
| ▸ | UBE2N | P61088 | 1/20 | 0.56 |
| ▸ | GAA | P10253 | 3/20 | 0.54 |
| ▸ | RORC | P51449 | 1/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL14069823 | 0.84 | MAPT (0.59) | PDE5AMAPTCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL11516149 | 0.83 | PDE5A (0.64) | PDE5AMAPTCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL11517104 | 0.82 | PDE5A (0.62) | PDE5AMAPTCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL11519026 | 0.82 | PDE5A (0.62) | PDE5AMAPTCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL11516869 | 0.82 | PDE5A (0.62) | PDE5AMAPTCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL24101688 | 0.80 | NPC1 (0.68) | MAPTCYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL10464324 | 0.78 | VCP (0.58) | PDE5AMAPTCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL11515699 | 0.78 | PDE5A (0.57) | PDE5AMAPTCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL4876936 | 0.76 | VCP (0.61) | MAPTCYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL24101768 | 0.76 | MAPT (0.79) | MAPTMEN1KMT2ALMNAHTT |
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-2021249517-A1 | A MOLECULAR GLUE REGULATING CDK12-DDB1 INTERACTION TO TRIGGER CYCLIN K DEGRADATION | NATIONAL INSTITUTE OF BIOLOGICAL SCIENCES, BEIJING (CN) | 2021-12-16 | — | — | WO | disclosed |