Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1D | P28221 | 2/20 | 0.42 |
| ▸ | BACE1 | P56817 | 2/20 | 0.38 |
| ▸ | NUDT1 | P36639 | 1/20 | 0.38 |
| ▸ | DPP4 | P27487 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | SLC18A3 | Q16572 | 1/20 | 0.35 |
| ▸ | SLC5A2 | P31639 | 1/20 | 0.34 |
| ▸ | PRMT5 | O14744 | 1/20 | 0.34 |
| ▸ | WDR77 | Q9BQA1 | 1/20 | 0.34 |
| ▸ | ACMSD | Q8TDX5 | 1/20 | 0.33 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.33 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.33 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.33 |
| ▸ | CXCR4 | P61073 | 1/20 | 0.33 |
| ▸ | CXCR3 | P49682 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL8945336 | 0.86 | ESR2 (0.37) | HTR1DALDH1A1CYP3A4TSHRTDP1 | |
| SCHEMBL8944934 | 0.84 | ALDH1A1 (0.33) | ALDH1A1CYP3A4TSHRTDP1SLC5A2 | |
| SCHEMBL8945557 | 0.83 | HTR1D (0.39) | HTR1DBACE1NUDT1ALDH1A1CYP3A4 | |
| SCHEMBL8945310 | 0.82 | CYP2C9 (0.43) | ALDH1A1CYP3A4TSHRTDP1 | |
| SCHEMBL8945085 | 0.82 | HTR1D (0.39) | HTR1DBACE1ALDH1A1CYP3A4TSHR | |
| SCHEMBL7751400 | 0.80 | ALDH1A1 (0.54) | BACE1NUDT1ALDH1A1CYP3A4TSHR | |
| SCHEMBL8945154 | 0.80 | EPHX2 (0.45) | HTR1DBACE1NUDT1ALDH1A1CYP3A4 | |
| SCHEMBL10718351 | 0.76 | CYP3A4 (0.52) | ALDH1A1CYP3A4TSHRTDP1 | |
| SCHEMBL31175764 | 0.76 | CYP3A4 (0.52) | ALDH1A1CYP3A4TSHRTDP1 | |
| SCHEMBL3902288 | 0.75 | ACMSD (0.41) | HTR1DBACE1DPP4CYP3A4ACMSD |
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 |