Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.40 |
| ▸ | ESR1 | P03372 | 1/20 | 0.38 |
| ▸ | ALOX5 | P09917 | 3/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | MGLL | Q99685 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 3/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.36 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.36 |
| ▸ | HCAR3 | P49019 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| Myristyl Alcohol SCHEMBL29023767 | 0.74 | GAA (0.49) | CYP3A4SMN1; SMN2ALDH1A1ESR1ALOX5 | |
| Dinitrophenylene SCHEMBL27643529 | 0.73 | ALDH1A1 (0.47) | CYP3A4SMN1; SMN2ALDH1A1GAAMAPT | |
| SCHEMBL3072804 | 0.73 | HTT (0.55) | SMN1; SMN2ALDH1A1ALOX5GAAMAPT | |
| SCHEMBL9678186 | 0.70 | ESR1 (0.71) | ALDH1A1ESR1NPC1MAPTRAB9A | |
| SCHEMBL9679699 | 0.70 | ESR1 (0.71) | ALDH1A1ESR1NPC1MAPTRAB9A | |
| SCHEMBL11700483 | 0.70 | ESR1 (0.71) | ALDH1A1ESR1NPC1MAPTRAB9A | |
| SCHEMBL9678194 | 0.70 | ESR1 (0.71) | ALDH1A1ESR1NPC1MAPTRAB9A | |
| SCHEMBL9733961 | 0.70 | PKM (0.64) | ALDH1A1MGLLGAAMAPTHDAC3 | |
| SCHEMBL9735264 | 0.70 | CYP3A4 (0.51) | CYP3A4SMN1; SMN2ALDH1A1ALOX5NPC1 | |
| SCHEMBL9734781 | 0.70 | PKM (0.64) | ALDH1A1MGLLGAAMAPTHDAC3 |
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-2004067623-A2 | POLYMIDE RESIN FOR NON-RUBBING VERTICAL ALIGNMENT MATERIALS AND PREPARATION METHOD THEREOF | KIM YONG-BAE (KR) | 2004-08-12 | — | — | WO | disclosed |