Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | USP2 | O75604 | 1/20 | 0.40 |
| ▸ | RECQL | P46063 | 1/20 | 0.40 |
| ▸ | CREBBP | Q92793 | 3/20 | 0.36 |
| ▸ | BRD4 | O60885 | 2/20 | 0.36 |
| ▸ | GAA | P10253 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.33 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | CASP1 | P29466 | 1/20 | 0.33 |
| ▸ | CASP7 | P55210 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.32 |
| ▸ | PLK1 | P53350 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL23937835 | 0.82 | KAT2B (0.38) | ALDH1A1USP2RECQLCREBBPBRD4 | |
| SCHEMBL19140344 | 0.76 | USP2 (0.45) | ALDH1A1USP2CREBBPGAAKMT2A | |
| SCHEMBL22289913 | 0.74 | GFER (0.46) | ALDH1A1USP2KMT2AKDM4EMEN1 | |
| SCHEMBL7532325 | 0.74 | HCAR2 (0.36) | ALDH1A1USP2KMT2AKDM4EMEN1 | |
| SCHEMBL4789593 | 0.73 | HSD17B10 (0.47) | ALDH1A1USP2BRD4KMT2AKDM4E | |
| SCHEMBL6164988 | 0.70 | KDM4E (0.41) | ALDH1A1KMT2AKDM4EMEN1HPGD | |
| SCHEMBL22289985 | 0.69 | MAPT (0.54) | ALDH1A1GAAKMT2AKDM4EMEN1 | |
| SCHEMBL22289963 | 0.69 | CXCR2 (0.36) | USP2GAAKMT2AADRA1AKDM4E | |
| SCHEMBL6160996 | 0.68 | ADORA2A (0.55) | ALDH1A1KMT2AHPGDPOLBRAB9A | |
| SCHEMBL7679755 | 0.67 | CFTR (0.56) | ALDH1A1KMT2AKDM4EMEN1MAPT |
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-3399968-B1 | SELECTIVE INHIBITORS OF CLINICALLY IMPORTANT MUTANTS OF THE EGFR TYROSINE KINASE | CS PHARMATECH LTD (KY) | 2021-10-20 | — | — | EP | disclosed |