Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | DHFR | P00374 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | SPHK1 | Q9NYA1 | 1/20 | 0.33 |
| ▸ | CCR5 | P51681 | 3/20 | 0.32 |
| ▸ | SLC5A2 | P31639 | 4/20 | 0.32 |
| ▸ | SLC5A1 | P13866 | 3/20 | 0.32 |
| ▸ | PDE4A | P27815 | 2/20 | 0.31 |
| ▸ | PDE4B | Q07343 | 2/20 | 0.31 |
| ▸ | PDE4C | Q08493 | 2/20 | 0.31 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL8945275 | 0.90 | SPHK1 (0.36) | CYP2C9ALDH1A1LMNAMAPTCYP3A4 | |
| SCHEMBL8945090 | 0.90 | CYP2C9 (0.47) | CYP2C9DHFRALDH1A1LMNAMAPT | |
| SCHEMBL8945230 | 0.87 | ALDH1A1 (0.33) | CYP2C9ALDH1A1LMNAMAPTCYP3A4 | |
| SCHEMBL8945085 | 0.86 | HTR1D (0.39) | DHFRALDH1A1MAPTCYP3A4TSHR | |
| SCHEMBL8944934 | 0.86 | ALDH1A1 (0.33) | CYP2C9ALDH1A1LMNAMAPTCYP3A4 | |
| SCHEMBL7753027 | 0.83 | CYP3A4 (0.47) | CYP2C9ALDH1A1LMNAMAPTCYP3A4 | |
| SCHEMBL8945434 | 0.81 | CYP2C9 (0.43) | CYP2C9ALDH1A1LMNAMAPTCYP3A4 | |
| SCHEMBL8767260 | 0.78 | ALDH1A1 (0.34) | CYP2C9DHFRALDH1A1CYP3A4TSHR | |
| SCHEMBL8945103 | 0.78 | SPHK1 (0.37) | ALDH1A1CYP3A4TSHRTDP1SPHK1 | |
| SCHEMBL7752389 | 0.78 | CYP2C9 (0.46) | CYP2C9ALDH1A1LMNAMAPTCYP3A4 |
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-5501884-A | Diamino compounds and their production method and liquid crystal alignment layers using the compounds | CHISSO CORPORATION (JP) | 1996-03-26 | — | — | US | disclosed |