Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNA7 | P36544 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | LMNA | P02545 | 3/20 | 0.38 |
| ▸ | GAA | P10253 | 2/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.36 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.36 |
| ▸ | PPARG | P37231 | 1/20 | 0.36 |
| ▸ | THRB | P10828 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | CES2 | O00748 | 1/20 | 0.34 |
| ▸ | CES1 | P23141 | 1/20 | 0.34 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.34 |
| ▸ | S1PR1 | P21453 | 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 | |
|---|---|---|---|---|
| SCHEMBL20157516 | 0.84 | ALDH1A1 (0.48) | CHRNA7ALDH1A1LMNAGAATDP1 | |
| SCHEMBL21362526 | 0.81 | CHRNA7 (0.35) | CHRNA7ALDH1A1LMNAHPGDMAPT | |
| SCHEMBL21362558 | 0.81 | DPP4 (0.40) | ALDH1A1LMNAGAATDP1THRB | |
| SCHEMBL20157552 | 0.80 | LMNA (0.38) | CHRNA7ALDH1A1LMNAGAATHRB | |
| SCHEMBL20157553 | 0.80 | POLB (0.36) | CHRNA7ALDH1A1LMNAGAATHRB | |
| SCHEMBL20157560 | 0.79 | PTPN1 (0.43) | ALDH1A1LMNAGAAMAPTHTT | |
| SCHEMBL21362538 | 0.79 | SRD5A2 (0.39) | CHRNA7ALDH1A1LMNAGAATDP1 | |
| SCHEMBL1252299 | 0.78 | GAA (0.50) | CHRNA7ALDH1A1LMNAGAATHRB | |
| SCHEMBL20157579 | 0.78 | TP53 (0.38) | CHRNA7ALDH1A1LMNAGAATDP1 | |
| SCHEMBL21362418 | 0.78 | THRA (0.47) | PPARGTHRB |
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-3539960-A1 | NITROGENOUS MACROCYCLIC COMPOUND, PREPARATION METHOD THEREFOR, PHARMACEUTICAL COMPOSITION AND APPLICATION THEREOF | Luoxin Pharmaceutical (Shanghai) Co., Ltd. (CN) | 2019-09-18 | — | — | EP | disclosed |