Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | RECQL | P46063 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | CA12 | O43570 | 2/20 | 0.38 |
| ▸ | CA9 | Q16790 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | CLCN2 | P51788 | 1/20 | 0.37 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.37 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.37 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.37 |
| ▸ | CNR2 | P34972 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL27667347 | 0.91 | ALDH1A1 (0.40) | ALDH1A1KDM4EMEN1KMT2ARECQL | |
| Phthalic Acid SCHEMBL7129666 | 0.87 | ALDH1A1 (0.56) | ALDH1A1KDM4EMEN1KMT2ARECQL | |
| SCHEMBL27667455 | 0.82 | CLCN2 (0.44) | ALDH1A1KDM4EMEN1KMT2ARECQL | |
| Salicylic Acid SCHEMBL6132155 | 0.82 | ALDH1A1 (0.55) | ALDH1A1KDM4EMEN1KMT2ARECQL | |
| SCHEMBL1355391 | 0.80 | ALDH1A1 (0.52) | ALDH1A1KDM4ECA2TSHRCA12 | |
| SCHEMBL28411582 | 0.79 | KDM4E (0.42) | ALDH1A1KDM4ECA2CA12CA9 | |
| SCHEMBL28045256 | 0.79 | ALDH1A1 (0.55) | ALDH1A1KDM4EMEN1KMT2ARECQL | |
| SCHEMBL28134185 | 0.77 | CA12 (0.43) | ALDH1A1KDM4EMEN1KMT2ARECQL | |
| SCHEMBL11422395 | 0.77 | ALDH1A1 (0.52) | ALDH1A1KDM4EMEN1KMT2ARECQL | |
| SCHEMBL28117846 | 0.76 | ALDH1A1 (0.51) | ALDH1A1KDM4EMEN1KMT2ARECQL |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-100569754-C | Have the synthetic and application of antitumour activity as the serial ion liquid of drug candidate | CHANGCHUN APPLIED CHEMISTRY (CN) | 2009-12-16 | — | — | CN | disclosed |
| CN-1970543-A | Synthesis and uses of serial ion liquid as candidate drug with anticancer activity | CHANGCHUN APPLIED CHEMISTRY (CN) | 2007-05-30 | — | — | CN | disclosed |