Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4D | Q08499 | 3/20 | 0.47 |
| ▸ | PDE4A | P27815 | 2/20 | 0.47 |
| ▸ | PDE4B | Q07343 | 2/20 | 0.47 |
| ▸ | PDE4C | Q08493 | 2/20 | 0.47 |
| ▸ | PDE7A | Q13946 | 2/20 | 0.46 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.46 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | PIP4K2A | P48426 | 1/20 | 0.39 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.39 |
| ▸ | PTGS2 | P35354 | 4/20 | 0.38 |
| ▸ | MAPT | P10636 | 3/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL28603778 | 0.87 | HTR2C (0.46) | PDE4DPDE4APDE4BPDE4CPDE7A | |
| SCHEMBL28594542 | 0.84 | THRB (0.39) | PDE4DPDE4APDE4BPDE4CKMT2A | |
| SCHEMBL28601409 | 0.83 | SMN1; SMN2 (0.44) | PDE4DPDE4APDE4BPDE4CPDE7A | |
| SCHEMBL28601406 | 0.80 | TUBB4A (0.46) | PDE4DTSHRPOLBABCB1MAPT | |
| SCHEMBL28602234 | 0.78 | ALDH1A1 (0.46) | KMT2AGAATSHRMAPK1MAPT | |
| SCHEMBL28611297 | 0.75 | ALPL (0.41) | PDE7AKMT2AMAPTALDH1A1SMN1; SMN2 | |
| SCHEMBL28601412 | 0.73 | CA12 (0.39) | PDE4AKMT2AMEN1MAPK1PTGS2 | |
| SCHEMBL28609103 | 0.72 | PGR (0.42) | KMT2AMEN1ABCB1ALDH1A1SMN1; SMN2 | |
| SCHEMBL28919027 | 0.72 | ALDH1A1 (0.39) | KMT2AMEN1TSHRPOLBPTGS2 | |
| SCHEMBL8250269 | 0.71 | SLC18A3 (0.43) | POLBALDH1A1HPGD |
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 |
|---|---|---|---|---|---|---|---|
| CN-113200983-A | Compound with pyrrolopyridine structure, preparation method and medical application | 中国药科大学 | 2021-08-03 | — | — | CN | disclosed |