Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.58 |
| ▸ | RELA | Q04206 | 4/20 | 0.53 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.50 |
| ▸ | PAOX | Q6QHF9 | 1/20 | 0.50 |
| ▸ | S1PR1 | P21453 | 6/20 | 0.45 |
| ▸ | S1PR3 | Q99500 | 6/20 | 0.45 |
| ▸ | S1PR2 | O95136 | 5/20 | 0.45 |
| ▸ | S1PR5 | Q9H228 | 3/20 | 0.45 |
| ▸ | CA12 | O43570 | 2/20 | 0.44 |
| ▸ | CA2 | P00918 | 2/20 | 0.44 |
| ▸ | CA4 | P22748 | 2/20 | 0.44 |
| ▸ | CA6 | P23280 | 2/20 | 0.44 |
| ▸ | CA5A | P35218 | 2/20 | 0.44 |
| ▸ | CA7 | P43166 | 2/20 | 0.44 |
| ▸ | CA9 | Q16790 | 2/20 | 0.44 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.44 |
| ▸ | CA5B | Q9Y2D0 | 2/20 | 0.44 |
| ▸ | CA3 | P07451 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| Trifluoroacetic Acid SCHEMBL5540177 | 0.88 | HDAC6 (0.50) | HDAC6RELAEPHX1PAOXS1PR1 | |
| Trifluoroacetic Acid SCHEMBL31581995 | 0.88 | HDAC6 (0.56) | HDAC6EPHX1PAOXS1PR1S1PR3 | |
| Trifluoroacetic Acid SCHEMBL31581884 | 0.88 | HDAC6 (0.56) | HDAC6EPHX1PAOXS1PR1S1PR3 | |
| Trifluoroacetic Acid SCHEMBL9443023 | 0.88 | HDAC6 (0.53) | HDAC6RELAEPHX1PAOXS1PR1 | |
| Spermine SCHEMBL674873 | 0.88 | HDAC6 (0.67) | HDAC6PAOXCA12CA2CA4 | |
| Spermine SCHEMBL3134527 | 0.88 | HDAC6 (0.67) | HDAC6PAOXCA12CA2CA4 | |
| Acetic Acid SCHEMBL134140 | 0.84 | PAOX (0.63) | HDAC6RELAPAOXS1PR1S1PR3 | |
| Hexadecylamine SCHEMBL23001148 | 0.84 | DNM1 (0.56) | EPHX1ALDH1A1TSHRMEN1CYP1A2 | |
| Decylamine SCHEMBL28610774 | 0.84 | DNM1 (0.56) | EPHX1ALDH1A1TSHRMEN1CYP1A2 | |
| Trifluoroacetic Acid SCHEMBL30275947 | 0.84 | DNM1 (0.56) | EPHX1ALDH1A1TSHRMEN1CYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0789708-A4 | MULTIFUNCTIONAL MOLECULAR COMPLEXES FOR GENE TRANSFER TO CELLS | APOLLON INC (US) | 1999-12-29 | — | — | EP | disclosed |
| EP-0789708-A1 | MULTIFUNCTIONAL MOLECULAR COMPLEXES FOR GENE TRANSFER TO CELLS | APOLLON, INC. (US) | 1997-08-20 | — | — | EP | disclosed |