Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.64 |
| ▸ | PDE5A | O76074 | 2/20 | 0.64 |
| ▸ | NPC1 | O15118 | 3/20 | 0.58 |
| ▸ | RAB9A | P51151 | 3/20 | 0.58 |
| ▸ | CDK5 | Q00535 | 7/20 | 0.58 |
| ▸ | CDK5R1 | Q15078 | 7/20 | 0.58 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.55 |
| ▸ | PDE1A | P54750 | 1/20 | 0.54 |
| ▸ | PDE1B | Q01064 | 1/20 | 0.54 |
| ▸ | PDE1C | Q14123 | 1/20 | 0.54 |
| ▸ | AOC3 | Q16853 | 2/20 | 0.54 |
| ▸ | KDM4A | O75164 | 1/20 | 0.53 |
| ▸ | KDM4B | O94953 | 1/20 | 0.53 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.53 |
| ▸ | KDM5B | Q9UGL1 | 1/20 | 0.53 |
| ▸ | CCNE2 | O96020 | 1/20 | 0.52 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.52 |
| ▸ | CDK2 | P24941 | 1/20 | 0.52 |
| ▸ | SCD | O00767 | 1/20 | 0.52 |
| ▸ | MEN1 | O00255 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL2664522 | 0.82 | KDM4E (0.66) | KDM4EPDE5ANPC1RAB9ACDK5 | |
| SCHEMBL2664517 | 0.82 | KDM4E (0.69) | KDM4EPDE5ANPC1RAB9ACDK5 | |
| SCHEMBL27599948 | 0.82 | KDM4E (0.78) | KDM4EPDE5ANPC1RAB9ASMN1; SMN2 | |
| SCHEMBL2227204 | 0.82 | KDM4E (0.69) | KDM4EPDE5ANPC1RAB9ACDK5 | |
| SCHEMBL91391 | 0.82 | KDM4E (0.69) | KDM4EPDE5ANPC1RAB9ACDK5 | |
| SCHEMBL27782868 | 0.80 | AOC3 (0.74) | KDM4EPDE5ANPC1RAB9ACDK5 | |
| SCHEMBL5717620 | 0.80 | KDM4E (0.74) | KDM4EPDE5ANPC1RAB9ACDK5 | |
| SCHEMBL3904033 | 0.79 | SMN1; SMN2 (0.65) | KDM4ENPC1RAB9ACDK5CDK5R1 | |
| SCHEMBL25720785 | 0.77 | PDE5A (0.79) | KDM4EPDE5ANPC1RAB9ASMN1; SMN2 | |
| SCHEMBL27782870 | 0.76 | SMN1; SMN2 (0.62) | KDM4EPDE5ANPC1RAB9ASMN1; SMN2 |
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-2004108722-A1 | ORTHOCONDENSED POLYCYCLIC AMINOPYRROLE DERIVATIVES COMPRISING AN ELECTRO-ATTRACTIVE SUBSTITUENT, COMBINATION PRODUCTS OF SAID DERIVATIVES, AND METHOD FOR THE PRODUCTION THEREOF | PIERRE FABRE UROLOGIE (FR) | 2004-12-16 | — | — | WO | disclosed |