Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RXRA | P19793 | 3/20 | 0.40 |
| ▸ | MAPT | P10636 | 5/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.36 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | RARA | P10276 | 1/20 | 0.33 |
| ▸ | RARB | P10826 | 1/20 | 0.33 |
| ▸ | RARG | P13631 | 1/20 | 0.33 |
| ▸ | RXRB | P28702 | 1/20 | 0.33 |
| ▸ | RXRG | P48443 | 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 | |
|---|---|---|---|---|
| SCHEMBL20157705 | 0.88 | MAPT (0.49) | RXRAMAPTNPC1MAPK1HTT | |
| SCHEMBL20157704 | 0.85 | NPC1 (0.44) | RXRAMAPTNPC1MAPK1HTT | |
| SCHEMBL20158003 | 0.79 | ALDH1A1 (0.46) | RXRAMAPTNPC1MAPK1HTT | |
| SCHEMBL30294917 | 0.73 | LCK (0.48) | MAPTHTTKMT2AHPGD | |
| SCHEMBL20157492 | 0.73 | MAPT (0.57) | RXRAMAPTNPC1MAPK1HTT | |
| SCHEMBL3689533 | 0.72 | GAA (0.46) | MAPTNPC1HTTRAB9AKMT2A | |
| SCHEMBL5477632 | 0.71 | MAPT (0.48) | MAPTNPC1MAPK1HTTRAB9A | |
| SCHEMBL20157720 | 0.71 | MAPT (0.44) | RXRAMAPTNPC1MAPK1HTT | |
| SCHEMBL20157995 | 0.71 | MAPT (0.44) | RXRAMAPTNPC1MAPK1HTT | |
| SCHEMBL21362731 | 0.70 | NPC1 (0.38) | RXRAMAPTNPC1MAPK1HTT |
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 |