Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.68 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.68 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.68 |
| ▸ | HTT | P42858 | 2/20 | 0.68 |
| ▸ | MEN1 | O00255 | 3/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.52 |
| ▸ | MMP13 | P45452 | 2/20 | 0.51 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.49 |
| ▸ | LTA4H | P09960 | 1/20 | 0.48 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.47 |
| ▸ | BCHE | P06276 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 3/20 | 0.46 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.45 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL18664540 | 0.92 | ALDH1A1 (0.57) | ALDH1A1SMN1; SMN2KDM4EHTTMEN1 | |
| SCHEMBL13948896 | 0.85 | ALDH1A1 (0.70) | ALDH1A1SMN1; SMN2KDM4EHTTMEN1 | |
| SCHEMBL14266673 | 0.83 | KDM4E (0.76) | ALDH1A1SMN1; SMN2KDM4EHTTMEN1 | |
| SCHEMBL2937730 | 0.81 | ALDH1A1 (0.60) | ALDH1A1SMN1; SMN2KDM4EHTTMEN1 | |
| SCHEMBL12890739 | 0.81 | ALDH1A1 (0.65) | ALDH1A1SMN1; SMN2KDM4EHTTMEN1 | |
| SCHEMBL13958845 | 0.81 | ALDH1A1 (0.65) | ALDH1A1SMN1; SMN2KDM4EHTTMEN1 | |
| SCHEMBL24061766 | 0.80 | ALDH1A1 (0.68) | ALDH1A1SMN1; SMN2KDM4EHTTMEN1 | |
| SCHEMBL327459 | 0.80 | KDM4E (0.62) | ALDH1A1SMN1; SMN2KDM4EHTTMEN1 | |
| SCHEMBL4166427 | 0.78 | ALDH1A1 (0.60) | ALDH1A1SMN1; SMN2KDM4EHTTMEN1 | |
| SCHEMBL1681007 | 0.78 | SMN1; SMN2 (0.60) | ALDH1A1SMN1; SMN2KDM4EHTTMMP13 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2017048962-A1 | HEPATITIS B CORE PROTEIN MODULATORS | ASSEMBLY BIOSCIENCES, INC. (US) | 2017-03-23 | — | — | WO | disclosed |