Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.50 |
| ▸ | TLR4 | O00206 | 1/20 | 0.35 |
| ▸ | ADH1A | P07327 | 3/20 | 0.34 |
| ▸ | ADH1C | P00326 | 2/20 | 0.34 |
| ▸ | ADH1B | P00325 | 1/20 | 0.34 |
| ▸ | ADH4 | P08319 | 1/20 | 0.34 |
| ▸ | ADH7 | P40394 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.32 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.32 |
| ▸ | RELA | Q04206 | 1/20 | 0.32 |
| ▸ | REN | P00797 | 4/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | NOS1 | P29475 | 1/20 | 0.31 |
| ▸ | NOS2 | P35228 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.30 |
| ▸ | 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 | |
|---|---|---|---|---|
| SCHEMBL12805540 | 0.96 | CYP1A2 (0.47) | CYP1A2TLR4ADH1AADH1CADH1B | |
| SCHEMBL12804968 | 0.96 | CYP1A2 (0.47) | CYP1A2TLR4ADH1AADH1CADH1B | |
| SCHEMBL12805823 | 0.96 | CYP1A2 (0.47) | CYP1A2TLR4ADH1AADH1CADH1B | |
| SCHEMBL12805723 | 0.95 | CYP1A2 (0.46) | CYP1A2TLR4ADH1AADH1CADH1B | |
| SCHEMBL12804897 | 0.95 | CYP1A2 (0.46) | CYP1A2TLR4ADH1AADH1CADH1B | |
| SCHEMBL12805537 | 0.95 | CYP1A2 (0.46) | CYP1A2TLR4ADH1AADH1CADH1B | |
| SCHEMBL12805790 | 0.95 | CYP1A2 (0.46) | CYP1A2TLR4ADH1AADH1CADH1B | |
| SCHEMBL12805360 | 0.95 | CYP1A2 (0.46) | CYP1A2TLR4ADH1AADH1CADH1B | |
| SCHEMBL12805576 | 0.95 | CYP1A2 (0.46) | CYP1A2TLR4ADH1AADH1CADH1B | |
| SCHEMBL11353507 | 0.93 | CYP1A2 (0.42) | CYP1A2ADH1AADH1CADH4HTT |
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 |
|---|---|---|---|---|---|---|---|
| CN-110959024-A | Detergent composition containing perfume | 罗地亚经营管理公司 | 2020-04-03 | — | — | CN | disclosed |