Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAP4K4 | O95819 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 3/20 | 0.38 |
| ▸ | USP2 | O75604 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.37 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | PI4KA | P42356 | 1/20 | 0.35 |
| ▸ | PI4K2B | Q8TCG2 | 1/20 | 0.35 |
| ▸ | PI4K2A | Q9BTU6 | 1/20 | 0.35 |
| ▸ | PI4KB | Q9UBF8 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.34 |
| ▸ | MRGPRX1 | Q96LB2 | 2/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 3/20 | 0.32 |
| ▸ | NPC1 | O15118 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.32 |
| ▸ | XBP1 | P17861 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL5135022 | 0.80 | ADORA2A (0.44) | RAB9AUSP2SMN1; SMN2ADORA2APKM | |
| SCHEMBL5135030 | 0.76 | GAPDH (0.42) | MAP4K4RAB9AADORA2API4KAPI4K2B | |
| SCHEMBL5135024 | 0.73 | ADORA2A (0.43) | RAB9AUSP2SMN1; SMN2ADORA2APKM | |
| SCHEMBL5664809 | 0.71 | LDHA (0.40) | RAB9AADORA2API4KAPI4K2BPI4K2A | |
| SCHEMBL4364907 | 0.69 | CYP1A2 (0.59) | MAP4K4RAB9ASMN1; SMN2PI4KAPI4K2B | |
| SCHEMBL5135297 | 0.69 | APAF1 (0.43) | MAP4K4ADORA2API4KAPI4K2BPI4K2A | |
| SCHEMBL5135369 | 0.68 | CES1 (0.48) | RAB9ASMN1; SMN2ADORA2ANPC1HTT | |
| SCHEMBL5135370 | 0.63 | CES1 (0.47) | RAB9ASMN1; SMN2ADORA2ANPC1HTT | |
| SCHEMBL19258239 | 0.63 | ADORA2A (0.56) | RAB9AUSP2SMN1; SMN2ADORA2APKM | |
| SCHEMBL3075421 | 0.62 | ADORA2A (0.75) | MAP4K4RAB9ASMN1; SMN2ADORA2API4KA |
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-20080268460-A1 | Assays to Identify Irreversibly Binding Inhibitors of Receptor Tyrosine Kinases | WYETH (US) | 2008-10-30 | — | — | US | disclosed |