Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | TSHR | P16473 | 2/20 | 0.43 |
| ▸ | NAAA | Q02083 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | ATM | Q13315 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | DGKA | P23743 | 1/20 | 0.35 |
| ▸ | P2RY10 | O00398 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL9461450 | 0.87 | ALDH1A1 (0.54) | ALDH1A1TSHRCYP3A4ALOX15TDP1 | |
| SCHEMBL11744826 | 0.86 | ALDH1A1 (0.44) | ALDH1A1TSHRCYP3A4ALOX15TDP1 | |
| SCHEMBL11685068 | 0.86 | CYP3A4 (0.40) | ALDH1A1NAAACYP3A4MAPTMAPK1 | |
| SCHEMBL11690303 | 0.85 | ALDH1A1 (0.53) | ALDH1A1TSHRCYP3A4ALOX15TDP1 | |
| SCHEMBL11747273 | 0.82 | LPAR1 (0.42) | ALDH1A1TSHRP2RY10 | |
| SCHEMBL11740600 | 0.81 | ALDH1A1 (0.41) | ALDH1A1TSHRCYP3A4ALOX15TDP1 | |
| SCHEMBL3675752 | 0.79 | POLB (0.43) | ALDH1A1TSHRCYP3A4TDP1L3MBTL1 | |
| SCHEMBL11745263 | 0.79 | ALDH1A1 (0.43) | ALDH1A1TSHRCYP3A4ALOX15TDP1 | |
| SCHEMBL9000615 | 0.78 | POLB (0.42) | POLB | |
| SCHEMBL7216304 | 0.77 | ALDH1A1 (0.43) | ALDH1A1TSHRCYP3A4ALOX15TDP1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-103562191-B | Nitrogen-containing saturated heterocyclic compound | SHANGHAI PHARMACEUTICALS HOLDING CO.,LTD. (CN) | 2016-03-30 | — | — | CN | disclosed |