Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 9/20 | 0.33 |
| ▸ | BACE1 | P56817 | 1/20 | 0.33 |
| ▸ | BACE2 | Q9Y5Z0 | 1/20 | 0.33 |
| ▸ | MMP2 | P08253 | 2/20 | 0.31 |
| ▸ | MMP9 | P14780 | 2/20 | 0.31 |
| ▸ | MMP8 | P22894 | 2/20 | 0.31 |
| ▸ | MMP13 | P45452 | 2/20 | 0.31 |
| ▸ | NR5A2 | O00482 | 1/20 | 0.31 |
| ▸ | NR5A1 | Q13285 | 1/20 | 0.31 |
| ▸ | HTR2C | P28335 | 3/20 | 0.31 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.31 |
| ▸ | DRD2 | P14416 | 1/20 | 0.30 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.30 |
| ▸ | HTR2A | P28223 | 1/20 | 0.30 |
| ▸ | SLC6A4 | P31645 | 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 | |
|---|---|---|---|---|
| SCHEMBL8945226 | 1.00 | CYP19A1 (0.33) | CYP19A1BACE1BACE2MMP2MMP9 | |
| SCHEMBL8945363 | 1.00 | CYP19A1 (0.33) | CYP19A1BACE1BACE2MMP2MMP9 | |
| SCHEMBL8945127 | 0.99 | CYP19A1 (0.32) | CYP19A1BACE1BACE2HTR2CHDAC4 | |
| SCHEMBL8945008 | 0.96 | HTR2C (0.32) | CYP19A1HTR2CHDAC4 | |
| SCHEMBL8945195 | 0.91 | HTR2C (0.33) | HTR2CHDAC4 | |
| SCHEMBL8945379 | 0.88 | HTR2C (0.37) | CYP19A1MMP2MMP9MMP8MMP13 | |
| SCHEMBL8945288 | 0.88 | HTR2C (0.37) | CYP19A1MMP2MMP9MMP8MMP13 | |
| SCHEMBL8945242 | 0.88 | HTR2C (0.37) | CYP19A1MMP2MMP9MMP8MMP13 | |
| SCHEMBL8945404 | 0.87 | HTR2C (0.35) | HTR2CHDAC4HTR2A | |
| SCHEMBL8945139 | 0.87 | HTR2C (0.38) | CYP19A1MMP2MMP9MMP8MMP13 |
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 |