Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.56 |
| ▸ | NPSR1 | Q6W5P4 | 6/20 | 0.55 |
| ▸ | HPGD | P15428 | 5/20 | 0.55 |
| ▸ | HTT | P42858 | 5/20 | 0.55 |
| ▸ | LMNA | P02545 | 4/20 | 0.55 |
| ▸ | TSHR | P16473 | 3/20 | 0.55 |
| ▸ | PKM | P14618 | 3/20 | 0.55 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.55 |
| ▸ | XBP1 | P17861 | 2/20 | 0.55 |
| ▸ | MEN1 | O00255 | 2/20 | 0.55 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.55 |
| ▸ | TP53 | P04637 | 2/20 | 0.55 |
| ▸ | MAPT | P10636 | 2/20 | 0.55 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.55 |
| ▸ | RAB9A | P51151 | 1/20 | 0.55 |
| ▸ | JAK2 | O60674 | 3/20 | 0.50 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.50 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL5014051 | 0.91 | ALDH1A1 (0.58) | ALDH1A1NPSR1HPGDHTTLMNA | |
| SCHEMBL18262489 | 0.90 | ALDH1A1 (0.46) | ALDH1A1NPSR1HPGDHTTLMNA | |
| SCHEMBL8174332 | 0.90 | ALDH1A1 (0.46) | ALDH1A1NPSR1HPGDHTTLMNA | |
| SCHEMBL7735821 | 0.90 | MAPT (0.47) | ALDH1A1NPSR1HPGDHTTLMNA | |
| SCHEMBL8174330 | 0.90 | ALDH1A1 (0.46) | ALDH1A1NPSR1HPGDHTTLMNA | |
| SCHEMBL801072 | 0.88 | PPARA (0.51) | ALDH1A1NPSR1HPGDHTTLMNA | |
| SCHEMBL21129189 | 0.86 | ALDH1A1 (0.52) | ALDH1A1NPSR1HPGDHTTLMNA | |
| SCHEMBL12980639 | 0.84 | C3AR1 (0.46) | ALDH1A1NPSR1HPGDHTTLMNA | |
| SCHEMBL10045822 | 0.84 | C3AR1 (0.46) | ALDH1A1NPSR1HPGDHTTLMNA | |
| SCHEMBL22648524 | 0.82 | C3AR1 (0.47) | ALDH1A1HTTLMNATSHRHSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008009942-A1 | HETEROAROMATIC-BASED PEPTIDE MACROCYCLES AS G-QUADRUPLEX LIGANDS | CAMBRIDGE ENTERPRISE LTD. (GB) | 2008-01-24 | — | — | WO | disclosed |