Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | PGR | P06401 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | MAOA | P21397 | 1/20 | 0.36 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | AVPR2 | P30518 | 1/20 | 0.36 |
| ▸ | HTR2B | P41595 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.36 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.36 |
| ▸ | SLC29A1 | Q99808 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | CYP4F2 | P78329 | 2/20 | 0.33 |
| ▸ | CYP4A11 | Q02928 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL5616030 | 0.74 | CASP1 (0.38) | CYP2C19LMNAPGRCYP3A4CYP2D6 | |
| SCHEMBL10920679 | 0.73 | CYP1A2 (0.44) | CYP2C19LMNAMAPTHTTALDH1A1 | |
| SCHEMBL2235608 | 0.70 | LMNA (0.36) | CYP2C19LMNAPGRCYP3A4CYP2D6 | |
| SCHEMBL12479632 | 0.69 | TNKS2 (0.41) | LMNATDP1ALDH1A1CYP4A11CYP1A2 | |
| SCHEMBL10875012 | 0.68 | CASP1 (0.45) | CYP2C19MAPTTDP1ALDH1A1ADORA2A | |
| SCHEMBL16572125 | 0.68 | GAA (0.41) | — | |
| SCHEMBL33145 | 0.68 | ALDH1A1 (0.43) | CYP2C19LMNAMAPTHTTTDP1 | |
| SCHEMBL11936455 | 0.67 | CYP1A2 (0.38) | CYP2C19LMNAMAPTHTTALDH1A1 | |
| SCHEMBL15250874 | 0.67 | CYP1A2 (0.44) | LMNAMAPTPDE3ASLC29A1ALDH1A1 | |
| SCHEMBL6546788 | 0.67 | CYP1A2 (0.44) | LMNAMAPTPDE3ASLC29A1ALDH1A1 |
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-5502028-A | Herbicidal pyrimidinyl or triazinyl haloacetic acid derivatives | SCHERING AGROCHEMICALS LIMITED (GB) | 1996-03-26 | — | — | US | disclosed |