Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | DRD1 | P21728 | 2/20 | 0.36 |
| ▸ | DRD5 | P21918 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | ATM | Q13315 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | SLC18A3 | Q16572 | 1/20 | 0.35 |
| ▸ | S1PR1 | P21453 | 2/20 | 0.35 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.35 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.35 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.35 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.34 |
| ▸ | CNR1 | P21554 | 2/20 | 0.34 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.34 |
| ▸ | AKT1 | P31749 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL2602377 | 0.84 | AKT1 (0.43) | RAB9AALDH1A1LMNAMAPTAKT1 | |
| SCHEMBL2602428 | 0.75 | DHFR (0.35) | RAB9AALDH1A1MAPTPDE4BAKT1 | |
| SCHEMBL2602440 | 0.74 | PTGS2 (0.51) | — | |
| SCHEMBL2602426 | 0.73 | CA1 (0.53) | DRD1LMNA | |
| SCHEMBL21885770 | 0.71 | ALDH1A1 (0.45) | NPC1RAB9AALDH1A1LMNATP53 | |
| SCHEMBL18117721 | 0.71 | MAPT (0.54) | SIGMAR1NPC1RAB9AALDH1A1LMNA | |
| SCHEMBL13998682 | 0.70 | ALDH1A1 (0.52) | ALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL7158626 | 0.70 | AKT1 (0.52) | AKT1AKT2 | |
| SCHEMBL346325 | 0.69 | LMNA (0.59) | NPC1RAB9AALDH1A1LMNATP53 | |
| SCHEMBL8025878 | 0.69 | LMNA (0.59) | NPC1RAB9AALDH1A1LMNATP53 |
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-8362019-B2 | Synthesis and anti-proliferative effect of substituted imidazo[4,5-b]pyrazine compounds | SPELMAN COLLEGE (US) | 2013-01-29 | — | — | US | disclosed |