Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.54 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.54 |
| ▸ | RAB9A | P51151 | 2/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.45 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.45 |
| ▸ | KCNQ3 | O43525 | 1/20 | 0.43 |
| ▸ | KCNQ2 | O43526 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 3/20 | 0.43 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 4/20 | 0.41 |
| ▸ | POLB | P06746 | 2/20 | 0.41 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL5476158 | 0.85 | LMNA (0.58) | KDM4EHSD17B10RAB9ANPC1MAPT | |
| SCHEMBL5479399 | 0.84 | POLB (0.47) | KDM4EALDH1A1HSD17B10RAB9ANPC1 | |
| SCHEMBL6494258 | 0.84 | NPC1 (0.44) | KDM4EALDH1A1HSD17B10RAB9ANPC1 | |
| SCHEMBL5479456 | 0.82 | HIF1A (0.42) | KDM4EALDH1A1HSD17B10PTGS2ADORA2A | |
| SCHEMBL6494121 | 0.82 | ALDH1A1 (0.51) | KDM4EALDH1A1HSD17B10RAB9ANPC1 | |
| SCHEMBL3166068 | 0.82 | NPC1 (0.58) | RAB9ANPC1MAPTTP53CYP1A2 | |
| SCHEMBL9013632 | 0.82 | KDM4E (0.55) | KDM4EALDH1A1HSD17B10PTGS1PTGS2 | |
| SCHEMBL3560817 | 0.81 | KDM4E (0.54) | KDM4EALDH1A1HSD17B10RAB9APTGS1 | |
| SCHEMBL5484106 | 0.81 | CASP3 (0.48) | HIF1A | |
| SCHEMBL15658105 | 0.81 | PDE4D (0.49) | PTGS1PTGS2HIF1ALMNAPOLB |
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 |
|---|---|---|---|---|---|---|---|
| US-6844347-B1 | Cyclic guanosine monophosphate modulators; cardiovascular diseases; guanylate cyclase activation | AVENTIS PHARMA DEUTSCHLAND GMBH (DE) | 2005-01-18 | — | — | US | disclosed |
| EP-1112266-B1 | SUBSTITUTED 4-AMINO-2-ARYL-PYRIMIDINES, THEIR PRODUCTION AND USE AND PHARMACEUTICAL PREPARATIONS CONTAINING SAME | AVENTIS PHARMA GMBH (DE) | 2003-05-14 | — | — | EP | disclosed |