Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 4/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | PSIP1 | O75475 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.35 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.35 |
| ▸ | MCL1 | Q07820 | 2/20 | 0.35 |
| ▸ | PGR | P06401 | 1/20 | 0.34 |
| ▸ | MRGPRX1 | Q96LB2 | 3/20 | 0.33 |
| ▸ | NR2F2 | P24468 | 1/20 | 0.33 |
| ▸ | BRAF | P15056 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL20157667 | 0.87 | MAPT (0.43) | HPGDALDH1A1MAPTKDM4EPSIP1 | |
| SCHEMBL20157971 | 0.85 | NPC1 (0.44) | HPGDALDH1A1MAPTKDM4EPSIP1 | |
| SCHEMBL21362630 | 0.77 | HPGD (0.38) | HPGDALDH1A1MAPTKDM4ELMNA | |
| SCHEMBL20157477 | 0.75 | ALDH1A1 (0.52) | ALDH1A1MAPTKDM4ELMNA | |
| SCHEMBL21550169 | 0.74 | KMT2A (0.44) | HPGDALDH1A1MAPTKDM4EPSIP1 | |
| SCHEMBL20157979 | 0.72 | MAPT (0.43) | HPGDALDH1A1MAPTKDM4ELMNA | |
| SCHEMBL20157891 | 0.72 | KDM1A (0.43) | HPGDALDH1A1MAPTLMNA | |
| SCHEMBL21362746 | 0.70 | TAS1R3 (0.35) | HPGDMAPTTAS1R3TAS1R1MCL1 | |
| SCHEMBL20158009 | 0.68 | GAA (0.38) | ALDH1A1MAPTKDM4ELMNA | |
| SCHEMBL16658378 | 0.68 | PSIP1 (0.49) | HPGDALDH1A1MAPTKDM4EPSIP1 |
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 |