Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AHR | P35869 | 1/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | HTT | P42858 | 2/20 | 0.48 |
| ▸ | USP2 | O75604 | 1/20 | 0.48 |
| ▸ | GAA | P10253 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | P2RX7 | Q99572 | 3/20 | 0.44 |
| ▸ | MAPT | P10636 | 6/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.42 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 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 | |
|---|---|---|---|---|
| SCHEMBL17145459 | 1.00 | AHR (0.50) | AHRKDM4EHTTUSP2GAA | |
| SCHEMBL12701071 | 0.86 | NR4A1 (0.50) | KDM4EHTTUSP2GAAMEN1 | |
| SCHEMBL14898537 | 0.84 | P2RX7 (0.48) | AHRKDM4EHTTUSP2GAA | |
| SCHEMBL28227760 | 0.83 | ALDH1A1 (0.46) | KDM4EHTTUSP2GAAMEN1 | |
| SCHEMBL17433767 | 0.83 | BACE1 (0.51) | GAAKMT2AMAPTPOLBTP53 | |
| SCHEMBL29364387 | 0.82 | KDM4E (0.68) | KDM4EHTTUSP2GAAMEN1 | |
| SCHEMBL10263150 | 0.82 | KDM4E (0.68) | KDM4EHTTUSP2GAAMEN1 | |
| SCHEMBL17433840 | 0.82 | MEN1 (0.46) | KDM4EHTTUSP2GAAMEN1 | |
| SCHEMBL14113741 | 0.81 | ALDH1A1 (0.50) | KDM4EMEN1KMT2ACYP1A2MAPT | |
| SCHEMBL13209738 | 0.79 | KDM4E (0.69) | AHRKDM4EHTTUSP2GAA |
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-3708568-B1 | COMPOUND CAPABLE OF INHIBITING PHOSPHODIESTERASE 4, PREPARATION METHOD, AND MEDICAL USE THEREOF | HEFEI INDUSTRIAL PHARMACEUTICAL INST CO LTD (CN) | 2022-02-09 | — | — | EP | disclosed |