Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | SNCA | P37840 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.35 |
| ▸ | MAPT | P10636 | 6/20 | 0.35 |
| ▸ | MEN1 | O00255 | 4/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | TP53 | P04637 | 2/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | CASP1 | P29466 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL8680459 | 0.70 | MYC (0.35) | — | |
| SCHEMBL16118350 | 0.70 | AHR (0.33) | ALDH1A1HSD17B10KDM4EMAPTHTT | |
| SCHEMBL19868327 | 0.69 | CREBBP (0.35) | TSHRHTTHPGDSMN1; SMN2 | |
| SCHEMBL3558245 | 0.69 | KMT2A (0.50) | CYP3A4ALDH1A1HSD17B10TSHRSNCA | |
| SCHEMBL7592184 | 0.69 | CYP3A4 (0.41) | CYP3A4ALDH1A1HSD17B10TSHRSNCA | |
| SCHEMBL3034729 | 0.68 | CYP3A4 (0.46) | CYP3A4ALDH1A1HSD17B10TSHRSNCA | |
| SCHEMBL19264828 | 0.66 | — | — | |
| SCHEMBL3601302 | 0.66 | SNCA (0.44) | CYP3A4ALDH1A1HSD17B10TSHRSNCA | |
| SCHEMBL6230747 | 0.65 | SNCA (0.54) | CYP3A4ALDH1A1HSD17B10TSHRSNCA | |
| SCHEMBL5868399 | 0.64 | CYP3A4 (0.45) | CYP3A4ALDH1A1HSD17B10TSHRSNCA |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5750692-A | Synthesis of 3-deazapurines | ISIS PHARMACEUTICALS, INC. (US) | 1998-05-12 | — | — | US | claimed |