Known targets — ChEMBL curated mechanism
ADORA1ADORA2AADORA2BADORA3PDE3APDE3BPDE4APDE4BPDE4CPDE4D
The experimentally established mechanism targets of 2-Methoxybenzaldehyde. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.58 |
| ▸ | TLR2 | O60603 | 1/20 | 0.53 |
| ▸ | ERN1 | O75460 | 1/20 | 0.53 |
| ▸ | TLR1 | Q15399 | 1/20 | 0.53 |
| ▸ | TLR6 | Q9Y2C9 | 1/20 | 0.53 |
| ▸ | NFE2L2 | Q16236 | 3/20 | 0.53 |
| ▸ | TFEB | P19484 | 1/20 | 0.51 |
| ▸ | LMNA | P02545 | 6/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.50 |
| ▸ | MAPT | P10636 | 3/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.50 |
| ▸ | NPC1 | O15118 | 2/20 | 0.50 |
| ▸ | RAB9A | P51151 | 2/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.50 |
| ▸ | HTT | P42858 | 1/20 | 0.50 |
| ▸ | BCHE | P06276 | 1/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| 2-Methoxybenzaldehyde SCHEMBL7801604 | 0.87 | ALDH1A1 (0.46) | PTGDR2TLR2ERN1TLR1TLR6 | |
| Glycine SCHEMBL27869199 | 0.86 | ERN1 (0.76) | PTGDR2TLR2ERN1TLR1TLR6 | |
| 2-Methoxybenzaldehyde SCHEMBL28193905 | 0.86 | LMNA (0.63) | PTGDR2TLR2ERN1TLR1TLR6 | |
| 2-Methoxybenzaldehyde SCHEMBL28842447 | 0.84 | PTGDR2 (0.55) | PTGDR2TLR2ERN1TLR1TLR6 | |
| 2-Methoxybenzaldehyde SCHEMBL8469378 | 0.84 | ALDH1A1 (0.66) | PTGDR2TLR2ERN1TLR1TLR6 | |
| 2-Methoxybenzaldehyde SCHEMBL66490 | 0.84 | ALDH1A1 (0.66) | PTGDR2TLR2ERN1TLR1TLR6 | |
| 2-Methoxybenzaldehyde SCHEMBL29358929 | 0.84 | ALDH1A1 (0.66) | PTGDR2TLR2ERN1TLR1TLR6 | |
| 2-Methoxybenzaldehyde SCHEMBL8041437 | 0.83 | GRIK1 (0.56) | PTGDR2TLR2ERN1TLR1TLR6 | |
| 2-Methoxybenzaldehyde SCHEMBL8041436 | 0.83 | GRIK1 (0.56) | PTGDR2TLR2ERN1TLR1TLR6 | |
| 2-Methoxybenzaldehyde SCHEMBL28639538 | 0.82 | ALDH1A1 (0.63) | TLR2ERN1TLR1TLR6NFE2L2 |
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 |
|---|---|---|---|---|---|---|---|
| US-6127381-A | A MELANOCORTIN RECEPTOR LIGAND FOR REGULATING FOOD INTAKE AND BODY WEIGHT, REGULATING CYTOKINE ACTIVITY, ANTI-INFLAMMATORY ACTIVITY | LION BIOSCIENCE AG (DE) | 2000-10-03 | — | — | US | disclosed |