Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 8/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 5/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 6/20 | 0.40 |
| ▸ | USP2 | O75604 | 5/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 5/20 | 0.40 |
| ▸ | TSHR | P16473 | 3/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.40 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL28251675 | 0.78 | CYP1A2 (0.42) | CYP1A2CYP2C9HSD17B10CYP3A4USP2 | |
| Hydrochloric Acid SCHEMBL7659960 | 0.77 | CYP1A2 (0.41) | CYP1A2CYP2C9HSD17B10CYP3A4USP2 | |
| SCHEMBL10644213 | 0.68 | ADA (0.36) | CYP1A2CYP2C9HSD17B10CYP3A4USP2 | |
| SCHEMBL8319107 | 0.66 | EGFR (0.60) | CYP1A2CYP2C9HSD17B10CYP3A4CYP2C19 | |
| SCHEMBL3948301 | 0.65 | CHRNB4 (0.49) | MAPTKMT2AGAAEGFRFADS1 | |
| Hydrochloric Acid SCHEMBL7659957 | 0.64 | EGFR (0.44) | MAPTGAAEGFRFADS1LCK | |
| SCHEMBL3167054 | 0.63 | MEN1 (0.46) | HSD17B10TSHRALDH1A1MAPTMEN1 | |
| SCHEMBL27968165 | 0.63 | CYP1A2 (0.57) | CYP1A2CYP2C9HSD17B10CYP3A4USP2 | |
| SCHEMBL28171952 | 0.62 | ADA (0.42) | CYP1A2CYP2C9HSD17B10CYP3A4USP2 | |
| SCHEMBL31364914 | 0.60 | CCR4 (0.40) | CYP1A2USP2TSHRMEN1KMT2A |
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-1539760-A2 | AZAPURINE DERIVATIVES | INSTITUTE OF EXPERIMENTAL BOTANY ASCR (CZ) | 2005-06-15 | — | — | EP | claimed |
| WO-2004018473-A2 | AZAPURINE DERIVATIVES | INSTITUTE OF EXPERIMENTAL BOTANY ASCR (CZ) | 2004-03-04 | — | — | WO | claimed |