Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 12/20 | 0.71 |
| ▸ | FBP1 | P09467 | 6/20 | 0.67 |
| ▸ | ERBB2 | P04626 | 2/20 | 0.65 |
| ▸ | ERBB4 | Q15303 | 2/20 | 0.65 |
| ▸ | LMNA | P02545 | 1/20 | 0.62 |
| ▸ | MAPT | P10636 | 1/20 | 0.62 |
| ▸ | HTT | P42858 | 1/20 | 0.62 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.62 |
| ▸ | KDR | P35968 | 3/20 | 0.61 |
| ▸ | RET | P07949 | 1/20 | 0.61 |
| ▸ | KIF5B | P33176 | 1/20 | 0.61 |
| ▸ | CLK1 | P49759 | 1/20 | 0.59 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.59 |
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 | |
|---|---|---|---|---|
| SCHEMBL15217642 | 0.89 | FBP1 (0.77) | EGFRFBP1ERBB2ERBB4KDR | |
| SCHEMBL5565204 | 0.87 | KDR (0.79) | EGFRKDRRETKIF5BCLK1 | |
| SCHEMBL1657826 | 0.86 | EGFR (0.79) | EGFRFBP1ERBB2ERBB4LMNA | |
| SCHEMBL2100996 | 0.84 | EGFR (0.77) | EGFRFBP1ERBB2ERBB4 | |
| SCHEMBL4477758 | 0.83 | EGFR (0.77) | EGFRFBP1ERBB2ERBB4KDR | |
| SCHEMBL4469673 | 0.81 | JAK3 (0.79) | EGFRFBP1ERBB2ERBB4KDR | |
| SCHEMBL10080593 | 0.80 | FBP1 (0.65) | EGFRFBP1ERBB2ERBB4KDR | |
| SCHEMBL7119658 | 0.80 | FBP1 (1.00) | EGFRFBP1ERBB2ERBB4 | |
| SCHEMBL5606140 | 0.80 | FBP1 (1.00) | EGFRFBP1ERBB2ERBB4LMNA | |
| SCHEMBL3008965 | 0.80 | FBP1 (1.00) | EGFRFBP1ERBB2ERBB4MAPT |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2136799-B1 | MACROCYCLIC COMPOUNDS USEFUL AS INHIBITORS OF KINASES AND HSP90 | UNIV STRASBOURG (FR) | 2017-10-04 | — | — | EP | disclosed |
| US-8450305-B2 | Macrocyclic compounds useful as inhibitors of kinases and HSP90 | UNIVERSITE DE STRASBOURG (FR) | 2013-05-28 | — | — | US | disclosed |