Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.34 |
| ▸ | F3 | P13726 | 1/20 | 0.32 |
| ▸ | PIM1 | P11309 | 1/20 | 0.31 |
| ▸ | PIM3 | Q86V86 | 1/20 | 0.31 |
| ▸ | PIM2 | Q9P1W9 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL28066368 | 0.69 | CYP1A2 (0.44) | ALDH1A1HTTCYP1A2F3PIM1 | |
| SCHEMBL6745371 | 0.68 | ALDH1A1 (0.37) | ALDH1A1HTTCYP1A2F3PIM1 | |
| SCHEMBL28175288 | 0.65 | CYP1A2 (0.34) | ALDH1A1HTTCYP1A2F3PIM1 | |
| Methylamine SCHEMBL28226585 | 0.65 | ALDH1A1 (0.35) | ALDH1A1HTTCYP1A2F3PIM1 | |
| SCHEMBL11294752 | 0.63 | CYP1A2 (0.43) | ALDH1A1HTTCYP1A2F3PIM1 | |
| SCHEMBL11399507 | 0.61 | CYP1A2 (0.42) | ALDH1A1HTTCYP1A2F3HPGD | |
| SCHEMBL22471741 | 0.61 | CYP1A2 (0.34) | ALDH1A1HTTCYP1A2F3PIM1 | |
| SCHEMBL8401484 | 0.60 | CYP1A2 (0.33) | ALDH1A1HTTCYP1A2F3PIM1 | |
| SCHEMBL8401481 | 0.60 | CYP1A2 (0.33) | ALDH1A1HTTCYP1A2F3PIM1 | |
| SCHEMBL29179077 | 0.60 | PARP1 (0.39) | ALDH1A1HTTCYP1A2F3PIM1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6855950-B2 | Method for conductance switching in molecular electronic junctions | THE OHIO STATE UNIVERSITY (US) | 2005-02-15 | — | — | US | disclosed |
| US-20040007758-A1 | Method for conductance switching in molecular electronic junctions | THE OHIO STATE UNIVERSITY RESEARCH FOUNDATION | 2004-01-15 | — | — | US | disclosed |
| WO-2003081638-A2 | METHOD FOR CONDUCTANCE SWITCHING IN MOLECULAR ELECTRONIC JUNCTIONS | THE OHIO STATE UNIVERSITY (US) | 2003-10-02 | — | — | WO | disclosed |