Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PYGL | P06737 | 3/20 | 0.51 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.47 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.47 |
| ▸ | NOX4 | Q9NPH5 | 2/20 | 0.46 |
| ▸ | EGFR | P00533 | 2/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | RGS12 | O14924 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | LCK | P06239 | 1/20 | 0.46 |
| ▸ | CAMKK2 | Q96RR4 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | CA12 | O43570 | 1/20 | 0.45 |
| ▸ | CA1 | P00915 | 1/20 | 0.45 |
| ▸ | CA2 | P00918 | 1/20 | 0.45 |
| ▸ | CA9 | Q16790 | 1/20 | 0.45 |
| ▸ | PPARA | Q07869 | 1/20 | 0.45 |
| ▸ | STING1 | Q86WV6 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL29385739 | 0.87 | CA12 (0.60) | PYGLBCL2L1MCL1NOX4EGFR | |
| SCHEMBL15367533 | 0.87 | CA12 (0.60) | PYGLBCL2L1MCL1NOX4EGFR | |
| SCHEMBL16005387 | 0.87 | EGFR (0.60) | NOX4EGFRMAPTALDH1A1CA12 | |
| SCHEMBL27770271 | 0.82 | EGFR (0.60) | PYGLBCL2L1MCL1NOX4EGFR | |
| SCHEMBL27924601 | 0.78 | HSD17B10 (0.47) | PYGLEGFRALDH1A1CA12CA1 | |
| SCHEMBL27749184 | 0.76 | EGFR (0.60) | PYGLBCL2L1MCL1NOX4EGFR | |
| SCHEMBL3300413 | 0.76 | PPARA (0.73) | PYGLBCL2L1MCL1NOX4EGFR | |
| SCHEMBL7809127 | 0.74 | NOX4 (0.78) | NOX4EGFRMAPTRGS12ALDH1A1 | |
| SCHEMBL16005192 | 0.74 | EGFR (0.62) | NOX4EGFRMAPTCA12CA1 | |
| SCHEMBL16005147 | 0.73 | MAPT (0.45) | EGFRMAPTALDH1A1KMT2AKDM4E |
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-2774914-B1 | N-BENZYLANILINE DERIVATIVE AND USES THEREOF | UNIV NANJING MEDICAL (CN) | 2017-12-06 | — | — | EP | disclosed |