Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 4/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | ATM | Q13315 | 1/20 | 0.37 |
| ▸ | HTR2A | P28223 | 1/20 | 0.37 |
| ▸ | CDC25A | P30304 | 1/20 | 0.37 |
| ▸ | AKR1B1 | P15121 | 2/20 | 0.36 |
| ▸ | APEX1 | P27695 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.33 |
| ▸ | GLA | P06280 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 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 | |
|---|---|---|---|---|
| SCHEMBL11586315 | 0.88 | EGFR (0.40) | EGFRMAPTATMCDC25A | |
| SCHEMBL11587254 | 0.87 | EGFR (0.40) | EGFRMAPTCDC25A | |
| SCHEMBL11585500 | 0.87 | EGFR (0.40) | EGFRMAPTATMAKR1B1 | |
| SCHEMBL11589716 | 0.85 | EGFR (0.38) | EGFRMAPTATM | |
| SCHEMBL11586337 | 0.84 | EGFR (0.37) | EGFRMAPTCDC25AHSD17B10 | |
| SCHEMBL11585361 | 0.82 | PDK2 (0.43) | EGFRMAPTHSD17B10 | |
| SCHEMBL11587716 | 0.78 | SMN1; SMN2 (0.40) | MAPTTSHRCYP1A2 | |
| SCHEMBL11586288 | 0.77 | PTGS2 (0.37) | EGFRCDC25A | |
| SCHEMBL42370 | 0.75 | EGFR (0.51) | EGFRMAPTHTR2AAKR1B1TSHR | |
| SCHEMBL11585655 | 0.74 | AKR1C3 (0.36) | EGFRMAPTTSHRHSD17B10 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4070387-A | ANTIARRHYTHMIC AGENTS | MERCK & CO., INC. (US) | 1978-01-24 | — | — | US | disclosed |
| US-4020096-A | ANTIARRYTHMIA | MERCK & CO., INC. (US) | 1977-04-26 | — | — | US | disclosed |
| US-3950423-A | 10,11-Dihydro-10,10,11,11-tetrafluoro-5H-dibenzo[a,d]cycloheptene-5-methylamines | MERCK & CO., INC. (US) | 1976-04-13 | — | — | US | disclosed |