Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TLR4 | O00206 | 3/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.39 |
| ▸ | CCR2 | P41597 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | CYP19A1 | P11511 | 6/20 | 0.32 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.32 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.32 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.32 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.32 |
| ▸ | DRD2 | P14416 | 1/20 | 0.32 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.32 |
| ▸ | DRD4 | P21917 | 1/20 | 0.32 |
| ▸ | DRD3 | P35462 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL10450736 | 1.00 | TLR4 (0.44) | TLR4CYP1A2CCR2MEN1KMT2A | |
| SCHEMBL10450733 | 1.00 | TLR4 (0.44) | TLR4CYP1A2CCR2MEN1KMT2A | |
| SCHEMBL10450225 | 0.99 | TLR4 (0.43) | TLR4CYP1A2CCR2MEN1KMT2A | |
| SCHEMBL10450220 | 0.99 | TLR4 (0.43) | TLR4CYP1A2CCR2MEN1KMT2A | |
| SCHEMBL10450227 | 0.99 | TLR4 (0.43) | TLR4CYP1A2CCR2MEN1KMT2A | |
| SCHEMBL10450382 | 0.99 | TLR4 (0.43) | TLR4CYP1A2CCR2MEN1KMT2A | |
| SCHEMBL10450376 | 0.99 | TLR4 (0.43) | TLR4CYP1A2CCR2MEN1KMT2A | |
| SCHEMBL10450380 | 0.99 | TLR4 (0.43) | TLR4CYP1A2CCR2MEN1KMT2A | |
| SCHEMBL10449771 | 0.96 | TLR4 (0.45) | TLR4CYP1A2CCR2MEN1KMT2A | |
| SCHEMBL10449775 | 0.96 | TLR4 (0.45) | TLR4CYP1A2CCR2MEN1KMT2A |
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-4943384-A | LIQUID CRYSTALS | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1990-07-24 | — | — | US | disclosed |