Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.53 |
| ▸ | MAPT | P10636 | 5/20 | 0.53 |
| ▸ | RAB9A | P51151 | 4/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.53 |
| ▸ | NPC1 | O15118 | 2/20 | 0.53 |
| ▸ | PKM | P14618 | 1/20 | 0.53 |
| ▸ | CNR2 | P34972 | 2/20 | 0.50 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.50 |
| ▸ | CYP2A13 | Q16696 | 1/20 | 0.50 |
| ▸ | SNCA | P37840 | 1/20 | 0.49 |
| ▸ | HPGDS | O60760 | 1/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | KCNK3 | O14649 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 2/20 | 0.45 |
| ▸ | CHIA | Q9BZP6 | 1/20 | 0.45 |
| ▸ | S1PR2 | O95136 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL8317404 | 0.83 | SNCA (0.49) | ALDH1A1MAPTRAB9AKMT2ASMN1; SMN2 | |
| SCHEMBL8321364 | 0.80 | MAPT (0.50) | ALDH1A1MAPTRAB9AKMT2ASMN1; SMN2 | |
| SCHEMBL8317458 | 0.79 | PKM (0.49) | ALDH1A1MAPTRAB9AKMT2ASMN1; SMN2 | |
| SCHEMBL15087635 | 0.79 | CNR2 (0.71) | ALDH1A1MAPTRAB9AKMT2ASMN1; SMN2 | |
| SCHEMBL23964391 | 0.75 | CYP2A6 (0.66) | ALDH1A1MAPTRAB9AKMT2ASMN1; SMN2 | |
| SCHEMBL10954413 | 0.75 | ALDH1A1 (0.54) | ALDH1A1MAPTRAB9AKMT2ANPC1 | |
| SCHEMBL4458404 | 0.74 | HPGDS (0.79) | ALDH1A1KMT2AHPGDSLMNAHPGD | |
| Benzaldehyde SCHEMBL28191631 | 0.74 | CYP2A6 (0.83) | ALDH1A1MAPTRAB9AKMT2ASMN1; SMN2 | |
| SCHEMBL28677383 | 0.74 | LMNA (0.67) | ALDH1A1MAPTRAB9AKMT2ASMN1; SMN2 | |
| Acetic Acid SCHEMBL18059862 | 0.73 | CYP2A6 (0.79) | ALDH1A1MAPTRAB9AKMT2ASMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2004071401-A2 | HYDROXAMIC ACID DERIVATIVES AS HISTONE DEACETYLASE INHIBITORS (HDCA) | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 2004-08-26 | — | — | WO | disclosed |