Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | GLA | P06280 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | PTBP1 | P26599 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | RCE1 | Q9Y256 | 1/20 | 0.38 |
| ▸ | ACP1 | P24666 | 3/20 | 0.37 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.36 |
| ▸ | CNR2 | P34972 | 1/20 | 0.35 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.34 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.34 |
| ▸ | TNKS | O95271 | 1/20 | 0.34 |
| ▸ | WNT3A | P56704 | 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 | |
|---|---|---|---|---|
| SCHEMBL7757071 | 0.79 | ESR1 (0.41) | ESR1ALDH1A1HPGDGAARAB9A | |
| SCHEMBL27474210 | 0.76 | MAPT (0.52) | ALDH1A1GLAHPGDKDM4ENPC1 | |
| SCHEMBL28795494 | 0.72 | ALDH1A1 (0.55) | ESR1ALDH1A1GLAHPGDKDM4E | |
| SCHEMBL30075088 | 0.72 | ALDH1A1 (0.55) | ESR1ALDH1A1GLAHPGDKDM4E | |
| SCHEMBL7047670 | 0.71 | MAPT (0.59) | ALDH1A1GLAHPGDKDM4ENPC1 | |
| SCHEMBL28228752 | 0.70 | ALDH1A1 (0.56) | ESR1ALDH1A1GLAHPGDKDM4E | |
| SCHEMBL3056751 | 0.69 | NR4A1 (0.50) | ALDH1A1HPGDKDM4EPOLBGAA | |
| SCHEMBL23632661 | 0.68 | SCN9A (0.46) | ESR1ALDH1A1GLAHPGDABCG2 | |
| SCHEMBL23731489 | 0.68 | ALDH1A1 (0.45) | ALDH1A1NPC1GAARAB9AKMT2A | |
| SCHEMBL23632539 | 0.68 | RXRA (0.41) | KMT2ACNR2BRAFMAPK14 |
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-104761584-A | Acridinium ester derivative, synthesis method and application thereof | BEIJING LEADMAN BIOCHEMISTRY CO LTD | 2015-07-08 | — | — | CN | disclosed |