Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 5/20 | 0.46 |
| ▸ | HTR2C | P28335 | 5/20 | 0.46 |
| ▸ | HTR2B | P41595 | 5/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | CNR1 | P21554 | 2/20 | 0.36 |
| ▸ | CNR2 | P34972 | 2/20 | 0.36 |
| ▸ | CDK2 | P24941 | 1/20 | 0.36 |
| ▸ | KDR | P35968 | 2/20 | 0.35 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.35 |
| ▸ | PRKCA | P17252 | 1/20 | 0.35 |
| ▸ | GSK3B | P49841 | 1/20 | 0.35 |
| ▸ | EGFR | P00533 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | HTT | P42858 | 2/20 | 0.34 |
| ▸ | MITF | O75030 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 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 | |
|---|---|---|---|---|
| SCHEMBL19100671 | 0.77 | HTR6 (0.36) | HTR2AHTR2CHTR2BCNR1CNR2 | |
| SCHEMBL8951640 | 0.77 | TSHR (0.39) | TSHRALDH1A1CNR1CNR2NOTUM | |
| SCHEMBL22450702 | 0.75 | KMT2A (0.43) | ALDH1A1CNR1CNR2CDK2NOTUM | |
| SCHEMBL18508855 | 0.74 | HTR2C (0.44) | HTR2AHTR2CHTR2BALDH1A1CNR1 | |
| SCHEMBL28017049 | 0.73 | IMPDH2 (0.54) | TSHRALDH1A1KDRPRKCAGSK3B | |
| SCHEMBL1093965 | 0.73 | ALDH1A1 (0.54) | ALDH1A1KDRPRKCAGSK3BMAPT | |
| SCHEMBL3833273 | 0.72 | CDK2 (0.47) | HTR2AHTR2CHTR2BALDH1A1CDK2 | |
| SCHEMBL27872763 | 0.72 | POLB (0.41) | ALDH1A1CNR1CNR2CDK2MAPT | |
| SCHEMBL1685952 | 0.72 | MAPT (0.44) | TSHRALDH1A1EGFRMAPTHTT | |
| SCHEMBL29051449 | 0.71 | HTT (0.60) | ALDH1A1CNR1CNR2CDK2MAPT |
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 |