Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.30 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.30 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.30 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.30 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.30 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.30 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.30 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.30 |
| ▸ | HRH2 | P25021 | 1/20 | 0.30 |
| ▸ | HTR2A | P28223 | 1/20 | 0.30 |
| ▸ | HTR2C | P28335 | 1/20 | 0.30 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.30 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.30 |
| ▸ | HRH1 | P35367 | 1/20 | 0.30 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.30 |
| ▸ | DRD3 | P35462 | 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 | |
|---|---|---|---|---|
| SCHEMBL10700252 | 0.78 | TDP1 (0.34) | SLC6A2SLC6A4ADRA1ASLC6A3 | |
| SCHEMBL9722061 | 0.72 | — | — | |
| SCHEMBL443563 | 0.72 | MAOA (0.40) | LMNAOPRM1OPRK1 | |
| SCHEMBL17912773 | 0.70 | KCNA3 (0.39) | ADRA1ADRD3 | |
| SCHEMBL15063657 | 0.69 | ALDH1A1 (0.34) | LMNATSHR | |
| SCHEMBL20362170 | 0.67 | OPRM1 (0.36) | CYP1A2CYP2D6TSHROPRM1 | |
| SCHEMBL9792899 | 0.67 | SLC6A2 (0.31) | SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL7120876 | 0.66 | — | — | |
| SCHEMBL7930112 | 0.64 | — | — | |
| SCHEMBL960448 | 0.63 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0062809-B1 | USE OF NON-CYCLIC ACETALS OR KETALS AS NON-DISCOLOURING ANTIOZONANTS | BAYER AG (DE) | 1984-05-23 | — | — | EP | disclosed |
| US-4427817-A | Open-chain acetals or ketals as non-discoloring antiozonants for rubber | BAYER AKTIENGESELLSCHAFT (DE) | 1984-01-24 | — | — | US | disclosed |
| EP-0062809-A1 | Use of non-cyclic acetals or ketals as non-discolouring antiozonants | BAYER AG (DE) | 1982-10-20 | — | — | EP | disclosed |