Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NQO1 | P15559 | 4/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.52 |
| ▸ | LMNA | P02545 | 2/20 | 0.52 |
| ▸ | TP53 | P04637 | 2/20 | 0.52 |
| ▸ | TSHR | P16473 | 2/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.52 |
| ▸ | MEN1 | O00255 | 2/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.52 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.52 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.52 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.52 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.52 |
| ▸ | PCSK7 | Q16549 | 1/20 | 0.52 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.52 |
| ▸ | NPC1 | O15118 | 1/20 | 0.48 |
| ▸ | RAB9A | P51151 | 1/20 | 0.48 |
| ▸ | VKORC1 | Q9BQB6 | 4/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL7356922 | 0.79 | NQO1 (0.52) | NQO1ALDH1A1LMNATP53TSHR | |
| SCHEMBL1647996 | 0.78 | ALDH1A1 (0.61) | NQO1ALDH1A1LMNATP53TSHR | |
| SCHEMBL1649087 | 0.77 | NQO1 (0.67) | NQO1ALDH1A1LMNATP53TSHR | |
| SCHEMBL8945469 | 0.76 | NQO1 (0.49) | NQO1ALDH1A1LMNATP53TSHR | |
| SCHEMBL1647666 | 0.76 | LMNA (0.52) | NQO1ALDH1A1LMNATP53TSHR | |
| SCHEMBL8945436 | 0.74 | VKORC1 (0.55) | NQO1ALDH1A1LMNATP53TSHR | |
| SCHEMBL7379480 | 0.74 | VKORC1 (0.55) | NQO1ALDH1A1LMNATP53TSHR | |
| SCHEMBL8945430 | 0.74 | NPC1 (0.62) | NQO1ALDH1A1LMNATP53TSHR | |
| SCHEMBL8934502 | 0.73 | NQO1 (0.69) | NQO1ALDH1A1LMNATP53TSHR | |
| SCHEMBL1649884 | 0.73 | NQO1 (0.57) | NQO1ALDH1A1LMNATP53TSHR |
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 |
|---|---|---|---|---|---|---|---|
| US-20080319025-A1 | Therapeutic and Diagnostic Methods Dependent on CYP2A Enzymes | NICOGEN, INC. (CA) | 2008-12-25 | — | — | US | disclosed |
| US-7371414-B2 | Therapeutic and diagnostic methods dependent on CYP2A enzymes | NICOGEN, INC. (CA) | 2008-05-13 | — | — | US | disclosed |