Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 4/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 3/20 | 0.37 |
| ▸ | MAPT | P10636 | 3/20 | 0.37 |
| ▸ | GBA1 | P04062 | 3/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | RECQL | P46063 | 1/20 | 0.34 |
| ▸ | THRB | P10828 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 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 | |
|---|---|---|---|---|
| SCHEMBL10987032 | 1.00 | ALDH1A1 (0.43) | ALDH1A1NPSR1TDP1GAALMNA | |
| SCHEMBL10813192 | 0.69 | ALDH1A1 (0.44) | ALDH1A1NPSR1LMNAGBA1KDM4E | |
| SCHEMBL10432139 | 0.68 | KDM4E (0.43) | ALDH1A1NPSR1LMNAGBA1KDM4E | |
| SCHEMBL11237755 | 0.68 | ALDH1A1 (0.49) | ALDH1A1NPSR1TDP1GAALMNA | |
| SCHEMBL7537547 | 0.67 | ALDH1A1 (0.48) | ALDH1A1NPSR1TDP1GAALMNA | |
| SCHEMBL7542696 | 0.67 | ALDH1A1 (0.48) | ALDH1A1NPSR1TDP1GAALMNA | |
| SCHEMBL11206934 | 0.66 | ALDH1A1 (0.47) | ALDH1A1NPSR1TDP1GAALMNA | |
| SCHEMBL7068794 | 0.64 | KDM4E (0.40) | NPSR1LMNAGBA1KDM4EKMT2A | |
| SCHEMBL28306475 | 0.64 | KDM4E (0.40) | NPSR1LMNAGBA1KDM4EKMT2A | |
| SCHEMBL7314755 | 0.62 | GBA1 (0.41) | NPSR1LMNAGBA1KDM4EKMT2A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-60078952-A | — | — | None | — | — | JP | disclosed |
| JP-S6078952-A | 3,3,5-TRIMETHYLCYCLOHEXANE DERIVATIVE | DAICEL CHEM IND LTD | 1985-05-04 | — | — | JP | disclosed |