Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | HPGD | P15428 | 1/20 | 0.30 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL31361151 | 1.00 | CYP2A6 (0.33) | CYP2A6ALDH1A1HPGDMEN1MAPT | |
| SCHEMBL24108207 | 0.80 | ALDH1A1 (0.32) | ALDH1A1HPGDMEN1MAPTKMT2A | |
| SCHEMBL29549624 | 0.80 | CYP2A6 (0.35) | CYP2A6ALDH1A1HPGDMEN1MAPT | |
| SCHEMBL837132 | 0.80 | CYP2A6 (0.35) | CYP2A6ALDH1A1HPGDMEN1MAPT | |
| SCHEMBL31373503 | 0.78 | CYP2A6 (0.34) | CYP2A6ALDH1A1HPGDMEN1MAPT | |
| SCHEMBL24108192 | 0.78 | CYP2A6 (0.34) | CYP2A6ALDH1A1HPGDMEN1MAPT | |
| SCHEMBL24108611 | 0.77 | ESR2 (0.31) | ALDH1A1HPGDMEN1MAPTKMT2A | |
| SCHEMBL20488087 | 0.77 | CSNK2A1 (0.33) | ALDH1A1HPGDMEN1MAPTKMT2A | |
| SCHEMBL9899335 | 0.75 | KMT2A (0.34) | KMT2A | |
| SCHEMBL31361113 | 0.75 | KMT2A (0.34) | KMT2A |
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-2012078608-A1 | PREPARATION OF PHANTASMIDINE AND ANALOGUES THEREOF | BRANDEIS UNIVERSITY (US) | 2012-06-14 | — | — | WO | disclosed |
| WO-2012078608-A1 | PREPARATION OF PHANTASMIDINE AND ANALOGUES THEREOF | BRANDEIS UNIVERSITY (US) | 2012-06-14 | — | — | WO | disclosed |