Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FBP1 | P09467 | 7/20 | 0.91 |
| ▸ | EGFR | P00533 | 10/20 | 0.89 |
| ▸ | ERBB2 | P04626 | 4/20 | 0.89 |
| ▸ | ERBB4 | Q15303 | 3/20 | 0.89 |
| ▸ | KDR | P35968 | 6/20 | 0.87 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.87 |
| ▸ | GAK | O14976 | 1/20 | 0.87 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.87 |
| ▸ | ABL1 | P00519 | 1/20 | 0.87 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.87 |
| ▸ | CDK1 | P06493 | 1/20 | 0.87 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.87 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.87 |
| ▸ | MAPT | P10636 | 1/20 | 0.87 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.87 |
| ▸ | SRC | P12931 | 1/20 | 0.87 |
| ▸ | TSHR | P16473 | 1/20 | 0.87 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.87 |
| ▸ | EPHB2 | P29323 | 1/20 | 0.87 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.87 |
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 | |
|---|---|---|---|---|
| SCHEMBL3008965 | 0.95 | FBP1 (1.00) | FBP1EGFRERBB2ERBB4KDR | |
| SCHEMBL9423 | 0.93 | EGFR (1.00) | FBP1EGFRERBB2ERBB4KDR | |
| SCHEMBL29444884 | 0.93 | EGFR (1.00) | FBP1EGFRERBB2ERBB4KDR | |
| SCHEMBL30363011 | 0.93 | EGFR (1.00) | FBP1EGFRERBB2ERBB4KDR | |
| SCHEMBL8349430 | 0.92 | EGFR (0.91) | FBP1EGFRERBB2ERBB4KDR | |
| Hydrochloric Acid SCHEMBL29369196 | 0.92 | EGFR (1.00) | FBP1EGFRERBB2ERBB4KDR | |
| Hydrochloric Acid SCHEMBL93918 | 0.92 | EGFR (1.00) | FBP1EGFRERBB2ERBB4KDR | |
| Hydrochloric Acid SCHEMBL30362813 | 0.92 | EGFR (1.00) | FBP1EGFRERBB2ERBB4KDR | |
| SCHEMBL5742396 | 0.90 | EGFR (0.86) | FBP1EGFRERBB2ERBB4KDR | |
| SCHEMBL22367416 | 0.89 | FBP1 (1.00) | FBP1EGFRERBB2ERBB4KDR |
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-7868204-B2 | Inhibitors of histone deacetylase | METHYLGENE INC. (CA) | 2011-01-11 | — | — | US | disclosed |
| US-7838520-B2 | Inhibitors of histone deacetylase | METHYLGENE, INC. (CA) | 2010-11-23 | — | — | US | disclosed |
| US-7595343-B2 | Inhibitors of histone deacetylase | METHYLGENE, INC. (CA) | 2009-09-29 | — | — | US | disclosed |