Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1I2 | O75469 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 12/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 9/20 | 0.47 |
| ▸ | MAPT | P10636 | 4/20 | 0.45 |
| ▸ | LMNA | P02545 | 4/20 | 0.45 |
| ▸ | RAB9A | P51151 | 3/20 | 0.45 |
| ▸ | HPGD | P15428 | 3/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | GAA | P10253 | 3/20 | 0.43 |
| ▸ | TP53 | P04637 | 2/20 | 0.43 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL11110302 | 0.91 | NR1I2 (0.53) | NR1I2ALDH1A1KDM4EMAPTLMNA | |
| SCHEMBL11117972 | 0.89 | NR1I2 (0.45) | NR1I2ALDH1A1KDM4EMAPTLMNA | |
| SCHEMBL11126649 | 0.86 | NR1I2 (0.48) | NR1I2ALDH1A1KDM4EMAPTLMNA | |
| SCHEMBL10818560 | 0.84 | ALDH1A1 (0.53) | ALDH1A1KDM4EMAPTLMNARAB9A | |
| SCHEMBL7095670 | 0.84 | ALDH1A1 (0.50) | NR1I2ALDH1A1KDM4EMAPTLMNA | |
| SCHEMBL16415757 | 0.83 | NR1I2 (0.69) | NR1I2ALDH1A1KDM4EMAPTLMNA | |
| SCHEMBL24105748 | 0.82 | ALDH1A1 (0.67) | NR1I2ALDH1A1KDM4EMAPTLMNA | |
| SCHEMBL9178940 | 0.82 | ALDH1A1 (0.67) | NR1I2ALDH1A1KDM4EMAPTLMNA | |
| SCHEMBL11117136 | 0.81 | ALDH1A1 (0.48) | NR1I2ALDH1A1KDM4EMAPTLMNA | |
| SCHEMBL11018956 | 0.78 | NR1I2 (0.64) | NR1I2ALDH1A1KDM4EMAPTLMNA |
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-0111455-A2 | Unsaturated lactones | CIBA-GEIGY AG (CH) | 1984-06-20 | — | — | EP | disclosed |