Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | GLA | P06280 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | FABP4 | P15090 | 1/20 | 0.36 |
| ▸ | FABP5 | Q01469 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 4/20 | 0.35 |
| ▸ | BLM | P54132 | 2/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.35 |
| ▸ | THRB | P10828 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | PLG | P00747 | 1/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.35 |
| ▸ | RECQL | P46063 | 1/20 | 0.35 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL13355491 | 0.81 | CYP1A2 (0.43) | CYP1A2KMT2ALMNAALDH1A1ALOX15 | |
| SCHEMBL13220018 | 0.81 | CYP1A2 (0.43) | CYP1A2KMT2ALMNAALDH1A1ALOX15 | |
| SCHEMBL3031624 | 0.81 | CYP1A2 (0.43) | CYP1A2KMT2ALMNAALDH1A1ALOX15 | |
| SCHEMBL3042367 | 0.80 | CYP1A2 (0.42) | CYP1A2KMT2ALMNAALDH1A1ALOX15 | |
| SCHEMBL13220025 | 0.80 | CYP1A2 (0.42) | CYP1A2KMT2ALMNAALDH1A1ALOX15 | |
| SCHEMBL6695515 | 0.77 | KDM4E (0.42) | MAPK1ALDH1A1 | |
| SCHEMBL3025566 | 0.76 | CYP1A2 (0.44) | CYP1A2LMNAALDH1A1TSHRHTR4 | |
| SCHEMBL13219982 | 0.76 | CYP1A2 (0.44) | CYP1A2LMNAALDH1A1TSHRHTR4 | |
| SCHEMBL500357 | 0.75 | GLA (0.50) | SMN1; SMN2GLAKMT2AMEN1ALDH1A1 | |
| SCHEMBL12331664 | 0.75 | CYP1A2 (0.47) | CYP1A2SMN1; SMN2MAPK1GLAKMT2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-2189451-A1 | BENZAMIDE DERIVATIVES, THEIR PREPARATION AND USES IN MEDICINE THEREOF | Jiangsu Hengrui Medicine Co., Ltd. (CN) | 2010-05-26 | — | — | EP | disclosed |