Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNA7 | P36544 | 2/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | RXRA | P19793 | 1/20 | 0.34 |
| ▸ | DPP4 | P27487 | 2/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.33 |
| ▸ | BCHE | P06276 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | ATM | Q13315 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | CASP7 | P55210 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL21351938 | 0.83 | PTPN1 (0.42) | CHRNA7RXRAMAPK1MEN1KMT2A | |
| SCHEMBL21362417 | 0.81 | CHRNA7 (0.38) | CHRNA7HPGDALDH1A1LMNAMAPT | |
| SCHEMBL21352204 | 0.79 | CHRNA7 (0.36) | CHRNA7RXRAMAPK1LMNATP53 | |
| SCHEMBL20158155 | 0.74 | HDAC1 (0.42) | HPGDALDH1A1RXRAMAPK1LMNA | |
| SCHEMBL21564810 | 0.74 | MAPK1 (0.39) | CHRNA7ALDH1A1RXRAKDM4EMAPK1 | |
| SCHEMBL21351833 | 0.73 | RXRA (0.35) | CHRNA7RXRAMAPK1BCHELMNA | |
| SCHEMBL20157993 | 0.72 | PTPN1 (0.40) | RXRAMAPK1LMNATP53MAPT | |
| SCHEMBL21352150 | 0.72 | ALDH1A1 (0.43) | HPGDALDH1A1MAPK1LMNAMAPT | |
| SCHEMBL21351843 | 0.72 | NPC1 (0.34) | CHRNA7HPGDALDH1A1RXRALMNA | |
| SCHEMBL21351845 | 0.72 | MEN1 (0.35) | CHRNA7ALDH1A1RXRALMNAMEN1 |
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 |