Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSS | P25774 | 1/20 | 0.39 |
| ▸ | MAT2A | P31153 | 1/20 | 0.37 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.36 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.36 |
| ▸ | JAK2 | O60674 | 1/20 | 0.34 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.34 |
| ▸ | ABL1 | P00519 | 1/20 | 0.34 |
| ▸ | EGFR | P00533 | 1/20 | 0.34 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.34 |
| ▸ | LCK | P06239 | 1/20 | 0.34 |
| ▸ | CDK1 | P06493 | 1/20 | 0.34 |
| ▸ | CSF1R | P07333 | 1/20 | 0.34 |
| ▸ | LYN | P07948 | 1/20 | 0.34 |
| ▸ | RET | P07949 | 1/20 | 0.34 |
| ▸ | KIT | P10721 | 1/20 | 0.34 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.34 |
| ▸ | FER | P16591 | 1/20 | 0.34 |
| ▸ | FLT1 | P17948 | 1/20 | 0.34 |
| ▸ | FGFR3 | P22607 | 1/20 | 0.34 |
| ▸ | KDR | P35968 | 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 | |
|---|---|---|---|---|
| SCHEMBL22562572 | 0.94 | CTSS (0.39) | CTSSMAT2AABCB1ABCG2JAK2 | |
| SCHEMBL22562456 | 0.93 | ALDH1A3 (0.41) | CTSSMAT2ASYKCLK4ALDH1A3 | |
| SCHEMBL22562304 | 0.93 | CTSS (0.37) | CTSSMAT2AABCB1ABCG2SYK | |
| SCHEMBL22562567 | 0.91 | MAT2A (0.37) | CTSSMAT2AABCB1ABCG2JAK2 | |
| SCHEMBL22562574 | 0.91 | CTSS (0.41) | CTSSMAT2AABCB1ABCG2JAK2 | |
| SCHEMBL22562484 | 0.91 | CTSS (0.36) | CTSSMAT2AABCB1ABCG2SYK | |
| SCHEMBL21546838 | 0.90 | CTSS (0.40) | CTSSMAT2ACLK4ALDH1A3PDK2 | |
| SCHEMBL22562305 | 0.90 | ALDH1A3 (0.43) | CTSSMAT2ASYKCLK4ALDH1A3 | |
| SCHEMBL22562483 | 0.90 | CTSS (0.39) | CTSSMAT2AABCB1ABCG2SYK | |
| SCHEMBL22562440 | 0.89 | ALDH1A3 (0.41) | CTSSMAT2ASYKCLK4ALDH1A3 |
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-3418278-B1 | ORGANIC MOLECULES, IN PARTICULAR FOR USE IN OPTOELECTRONIC DEVICES | CYNORA GMBH (DE) | 2020-10-21 | — | — | EP | disclosed |