Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 4/20 | 0.61 |
| ▸ | TSHR | P16473 | 1/20 | 0.61 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.59 |
| ▸ | MEN1 | O00255 | 4/20 | 0.59 |
| ▸ | HSP90AA1 | P07900 | 3/20 | 0.56 |
| ▸ | HSP90AB1 | P08238 | 3/20 | 0.56 |
| ▸ | POLB | P06746 | 3/20 | 0.55 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.50 |
| ▸ | LMNA | P02545 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
| ▸ | GRM5 | P41594 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.48 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL26814867 | 0.88 | HPGD (0.58) | HPGDTSHRKMT2AMEN1HSP90AA1 | |
| SCHEMBL24746204 | 0.87 | KMT2A (0.71) | HPGDTSHRKMT2AMEN1HSP90AA1 | |
| SCHEMBL11976992 | 0.87 | KMT2A (0.71) | HPGDTSHRKMT2AMEN1HSP90AA1 | |
| SCHEMBL11976991 | 0.84 | POLB (0.57) | HPGDTSHRKMT2AMEN1HSP90AA1 | |
| SCHEMBL25442428 | 0.83 | HPGD (0.53) | HPGDTSHRKMT2AMEN1HSP90AA1 | |
| SCHEMBL13816278 | 0.83 | HSP90AA1 (0.79) | HPGDKMT2AHSP90AA1HSP90AB1POLB | |
| SCHEMBL16860673 | 0.83 | GLRA1 (0.63) | HPGDTSHRKMT2AMEN1HSP90AA1 | |
| SCHEMBL10724841 | 0.79 | POLB (0.81) | HPGDTSHRKMT2AMEN1POLB | |
| SCHEMBL104400 | 0.79 | KMT2A (0.78) | HPGDTSHRKMT2AMEN1POLB | |
| SCHEMBL20449044 | 0.78 | HPGD (0.87) | HPGDTSHRKMT2AMEN1POLB |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020260252-A1 | NEW MACROCYCLIC COMPOUNDS AND DERIVATIVES AS EGFR INHIBITORS | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2020-12-30 | — | — | WO | disclosed |