Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
| ▸ | CA9 | Q16790 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.36 |
| ▸ | ANPEP | P15144 | 1/20 | 0.35 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.34 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.34 |
| ▸ | RELA | Q04206 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.33 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | GLA | P06280 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | CASP1 | P29466 | 1/20 | 0.33 |
| ▸ | CASP7 | P55210 | 1/20 | 0.33 |
| ▸ | HPRT1 | P00492 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | LCK | P06239 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| Furan SCHEMBL28125568 | 0.88 | ALDH1A1 (0.39) | ALDH1A1KDM4EANPEPNFKB1NFKB2 | |
| SCHEMBL27289372 | 0.87 | HPRT1 (0.44) | ALDH1A1KDM4EANPEPNFKB1NFKB2 | |
| Phthalic Anhydride SCHEMBL27566419 | 0.84 | KDM4E (0.36) | ALDH1A1KDM4EANPEPNFKB1NFKB2 | |
| SCHEMBL27267954 | 0.81 | CA1 (0.43) | CA1CA9ALDH1A1KDM4EANPEP | |
| Phthalic Acid SCHEMBL27743950 | 0.81 | NR4A1 (0.42) | ALDH1A1KDM4ENFKB1NFKB2RELA | |
| Pyrrole SCHEMBL28093231 | 0.80 | ALDH1A1 (0.39) | ALDH1A1KDM4ENFKB1NFKB2RELA | |
| Terephthalic Acid SCHEMBL27628972 | 0.80 | KMT2A (0.44) | ALDH1A1KDM4ENFKB1NFKB2RELA | |
| SCHEMBL28081871 | 0.79 | ALDH1A1 (0.34) | ALDH1A1KDM4EANPEPNFKB1NFKB2 | |
| SCHEMBL28151712 | 0.78 | CA1 (0.37) | CA1CA9ALDH1A1KDM4EANPEP | |
| Furan SCHEMBL27321811 | 0.78 | HTR7 (0.40) | ALDH1A1KDM4EANPEPHPRT1CYP1A2 |
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-103180296-A | Piperidinone derivatives as mdm2 inhibitors for the treatment of cancer | AMGEN INC | 2013-06-26 | — | — | CN | disclosed |