Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.59 |
| ▸ | CRHBP | P24387 | 1/20 | 0.59 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.59 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.59 |
| ▸ | NOD2 | Q9HC29 | 6/20 | 0.56 |
| ▸ | NOD1 | Q9Y239 | 6/20 | 0.56 |
| ▸ | MEN1 | O00255 | 1/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.56 |
| ▸ | F10 | P00742 | 2/20 | 0.50 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.47 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.47 |
| ▸ | SRC | P12931 | 1/20 | 0.43 |
| ▸ | CNR2 | P34972 | 1/20 | 0.42 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | RECQL | P46063 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL31486613 | 0.94 | KDM4E (0.57) | KDM4ECRHBPCRHR2SMN1; SMN2NOD2 | |
| SCHEMBL14565663 | 0.86 | ALDH1A1 (0.55) | KDM4ECRHBPCRHR2SMN1; SMN2MEN1 | |
| SCHEMBL9940446 | 0.80 | SMN1; SMN2 (0.42) | KDM4ECRHBPCRHR2SMN1; SMN2NOD2 | |
| SCHEMBL31486847 | 0.80 | KDM4E (0.42) | KDM4ECRHBPCRHR2SMN1; SMN2NOD2 | |
| SCHEMBL6752352 | 0.80 | KDM4E (0.71) | KDM4ECRHBPCRHR2SMN1; SMN2NOD2 | |
| SCHEMBL15303078 | 0.79 | NTRK1 (0.44) | KDM4ECRHBPCRHR2SMN1; SMN2NOD2 | |
| SCHEMBL6750639 | 0.79 | KDM4E (0.64) | KDM4ECRHBPCRHR2SMN1; SMN2NOD2 | |
| SCHEMBL18322286 | 0.78 | KDM4E (0.73) | KDM4ECRHBPCRHR2SMN1; SMN2NOD2 | |
| SCHEMBL13742183 | 0.78 | KDM4E (0.70) | KDM4ECRHBPCRHR2SMN1; SMN2NOD2 | |
| SCHEMBL30489155 | 0.78 | KDM4E (0.73) | KDM4ECRHBPCRHR2SMN1; SMN2NOD2 |
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-1453801-B1 | SUBSTITUTED 2-AMINO-CYCLOALKANECARBOXAMIDES AND THEIR USE AS CYSTEINE PROTEASE INHIBITORS | HOFFMANN LA ROCHE (CH) | 2007-03-21 | — | — | EP | disclosed |