Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.45 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.42 |
| ▸ | USP2 | O75604 | 1/20 | 0.38 |
| ▸ | SLCO1B1 | Q9Y6L6 | 1/20 | 0.38 |
| ▸ | SLC1A3 | P43003 | 2/20 | 0.36 |
| ▸ | SLC1A2 | P43004 | 2/20 | 0.36 |
| ▸ | SLC1A1 | P43005 | 2/20 | 0.36 |
| ▸ | ACHE | P22303 | 2/20 | 0.32 |
| ▸ | BLM | P54132 | 2/20 | 0.31 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.31 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.31 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.31 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | PDE4A | P27815 | 1/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL31000531 | 0.95 | SLC7A5 (0.46) | TSHRSLC7A5USP2SLCO1B1SLC1A3 | |
| SCHEMBL1867460 | 0.95 | SLC7A5 (0.46) | TSHRSLC7A5USP2SLCO1B1SLC1A3 | |
| SCHEMBL1867465 | 0.95 | SLC7A5 (0.46) | TSHRSLC7A5USP2SLCO1B1SLC1A3 | |
| SCHEMBL2367281 | 0.95 | SLC7A5 (0.46) | TSHRSLC7A5USP2SLCO1B1SLC1A3 | |
| SCHEMBL1867463 | 0.95 | SLC7A5 (0.46) | TSHRSLC7A5USP2SLCO1B1SLC1A3 | |
| SCHEMBL23924442 | 0.95 | SLC7A5 (0.46) | TSHRSLC7A5USP2SLCO1B1SLC1A3 | |
| D,L-Threo-3-Hydroxyaspartic Acid SCHEMBL2553076 | 0.89 | TSHR (0.56) | TSHRSLC7A5USP2SLCO1B1SLC1A3 | |
| D,L-Threo-3-Hydroxyaspartic Acid SCHEMBL5019049 | 0.89 | TSHR (0.56) | TSHRSLC7A5USP2SLCO1B1SLC1A3 | |
| D,L-Threo-3-Hydroxyaspartic Acid SCHEMBL336361 | 0.89 | TSHR (0.56) | TSHRSLC7A5USP2SLCO1B1SLC1A3 | |
| D,L-Threo-3-Hydroxyaspartic Acid SCHEMBL336363 | 0.89 | TSHR (0.56) | TSHRSLC7A5USP2SLCO1B1SLC1A3 |
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-1814588-A2 | ANTIINFECTIVE LIPOPEPTIDES | Cubist Pharmaceuticals, Inc. (US) | 2007-08-08 | — | — | EP | disclosed |
| WO-2006110185-A2 | ANTIINFECTIVE LIPOPEPTIDES | CUBIST PHARMACEUTICALS, INC. (US) | 2006-10-19 | — | — | WO | disclosed |