Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 0.43 |
| ▸ | NPC1 | O15118 | 2/20 | 0.43 |
| ▸ | RAB9A | P51151 | 2/20 | 0.43 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.41 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.41 |
| ▸ | KDM5A | P29375 | 1/20 | 0.40 |
| ▸ | KDM5C | P41229 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL11602955 | 0.87 | GABRA1 (0.47) | ALDH1A1KDM4ESMN1; SMN2HPGDNPC1 | |
| SCHEMBL3468787 | 0.87 | KDM4E (0.56) | ALDH1A1KDM4ESMN1; SMN2HPGDNPC1 | |
| SCHEMBL3461299 | 0.85 | ALDH1A1 (0.57) | ALDH1A1KDM4ESMN1; SMN2HPGDNPC1 | |
| SCHEMBL28071261 | 0.82 | TSHR (0.46) | ALDH1A1KDM4ESMN1; SMN2HPGDNPC1 | |
| SCHEMBL28498314 | 0.82 | BCHE (0.47) | ALDH1A1KDM4ESMN1; SMN2HPGDNPC1 | |
| SCHEMBL3459654 | 0.82 | KDM4E (0.46) | ALDH1A1KDM4ESMN1; SMN2HPGDNPC1 | |
| SCHEMBL7263878 | 0.81 | ALDH1A1 (0.45) | ALDH1A1KDM4ESMN1; SMN2HTTTP53 | |
| SCHEMBL2849190 | 0.79 | ALDH1A1 (0.42) | ALDH1A1KDM4ESMN1; SMN2HPGDNPC1 | |
| SCHEMBL13038906 | 0.79 | CXCR5 (0.41) | ALDH1A1KDM4ESMN1; SMN2HPGDNPC1 | |
| SCHEMBL5085750 | 0.78 | ALDH1A1 (0.54) | ALDH1A1KDM4EHPGDL3MBTL1TSHR |
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-4264048-A | — | — | None | — | — | JP | disclosed |
| JP-H04264048-A | TRIFLUOROMETHYL COMPOUND | CHISSO CORP | 1992-09-18 | — | — | JP | disclosed |