Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.59 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.55 |
| ▸ | MEN1 | O00255 | 3/20 | 0.55 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.54 |
| ▸ | BRAF | P15056 | 1/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.51 |
| ▸ | LMNA | P02545 | 1/20 | 0.51 |
| ▸ | MAPT | P10636 | 1/20 | 0.51 |
| ▸ | HPGD | P15428 | 1/20 | 0.51 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.51 |
| ▸ | GAA | P10253 | 2/20 | 0.51 |
| ▸ | NAMPT | P43490 | 1/20 | 0.50 |
| ▸ | RAB9A | P51151 | 2/20 | 0.49 |
| ▸ | NPC1 | O15118 | 1/20 | 0.49 |
| ▸ | KCNJ6 | P48051 | 1/20 | 0.49 |
| ▸ | KCNJ5 | P48544 | 1/20 | 0.49 |
| ▸ | KCNJ3 | P48549 | 1/20 | 0.49 |
| ▸ | AURKA | O14965 | 1/20 | 0.49 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL17664559 | 0.88 | POLB (0.60) | TSHRKMT2AMEN1RXFP1ALDH1A1 | |
| SCHEMBL17664634 | 0.87 | SMN1; SMN2 (0.59) | KMT2AMEN1RXFP1BRAFALDH1A1 | |
| SCHEMBL2517076 | 0.85 | KMT2A (0.56) | KMT2AMEN1BRAFALDH1A1LMNA | |
| SCHEMBL20852342 | 0.85 | MEN1 (0.55) | TSHRKMT2AMEN1RXFP1BRAF | |
| SCHEMBL834743 | 0.84 | KMT2A (0.55) | TSHRKMT2AMEN1RXFP1BRAF | |
| SCHEMBL2516724 | 0.84 | KMT2A (0.55) | KMT2AMEN1BRAFALDH1A1LMNA | |
| SCHEMBL2517050 | 0.83 | KMT2A (0.48) | TSHRKMT2AMEN1RXFP1BRAF | |
| SCHEMBL2874245 | 0.83 | TSHR (0.49) | TSHRKMT2AMEN1RXFP1ALDH1A1 | |
| SCHEMBL17660199 | 0.82 | GAA (0.54) | TSHRKMT2AMEN1RXFP1LMNA | |
| SCHEMBL17660204 | 0.82 | KMT2A (0.53) | KMT2AMEN1BRAFALDH1A1LMNA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010128058-A1 | DIHYDROPYRIMIDINONES FOR USE AS BACE2 INHIBITORS | F. HOFFMANN-LA ROCHE AG (CH) | 2010-11-11 | — | — | WO | disclosed |
| WO-2008061236-A2 | SULFOXIMINES AS KINASE INHIBITORS | ALLERGAN, INC. (US) | 2008-05-22 | — | — | WO | disclosed |