Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP26A1 | O43174 | 2/20 | 0.39 |
| ▸ | CTSA | P10619 | 6/20 | 0.38 |
| ▸ | KEAP1 | Q14145 | 2/20 | 0.37 |
| ▸ | NFE2L2 | Q16236 | 2/20 | 0.37 |
| ▸ | POLB | P06746 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | ITGB1 | P05556 | 2/20 | 0.35 |
| ▸ | ITGA4 | P13612 | 2/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.34 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL688529 | 0.93 | CTSA (0.39) | CYP26A1CTSAKEAP1NFE2L2POLB | |
| SCHEMBL687925 | 0.90 | CYP26A1 (0.42) | CYP26A1CTSAKEAP1NFE2L2POLB | |
| SCHEMBL687511 | 0.88 | MEN1 (0.46) | CYP26A1CTSAKEAP1NFE2L2POLB | |
| SCHEMBL687896 | 0.88 | CTSA (0.41) | CYP26A1CTSAKEAP1NFE2L2POLB | |
| SCHEMBL687651 | 0.87 | CTSA (0.44) | CYP26A1CTSAPOLBMEN1KMT2A | |
| SCHEMBL688530 | 0.87 | CTSA (0.43) | CTSAPOLBMEN1KMT2AKDM4E | |
| SCHEMBL688110 | 0.87 | MEN1 (0.49) | CYP26A1CTSAKEAP1NFE2L2POLB | |
| SCHEMBL687280 | 0.86 | POLB (0.43) | CYP26A1CTSAPOLBMEN1KMT2A | |
| SCHEMBL687335 | 0.85 | CTSA (0.43) | CTSAPOLB | |
| SCHEMBL688357 | 0.85 | POLB (0.41) | CYP26A1CTSAKEAP1NFE2L2POLB |
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-1203766-B1 | Carboxylic acid derivatives that inhibit the binding of integrins to their receptors | ENCYSIVE PHARMACEUTICALS INC (US) | 2012-02-29 | — | — | EP | disclosed |
| EP-1203766-A2 | Carboxylic acid derivatives that inhibit the binding of integrins to their receptors | TEXAS BIOTECHNOLOGY CORPORATION (US) | 2002-05-08 | — | — | EP | disclosed |