Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | HTR1A | P08908 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | HTR2A | P28223 | 1/20 | 0.45 |
| ▸ | HTR2C | P28335 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.45 |
| ▸ | KCNH2 | Q12809 | 6/20 | 0.43 |
| ▸ | HTR3A | P46098 | 6/20 | 0.43 |
| ▸ | CHRNA7 | P36544 | 5/20 | 0.43 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.36 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.36 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.36 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL3202084 | 0.72 | CYP1A2 (0.46) | CYP1A2KMT2ACHRNB4CHRNA3 | |
| SCHEMBL1326312 | 0.70 | ALDH1A1 (0.44) | KDM4EMEN1ALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL11553446 | 0.69 | KDM4E (0.58) | KDM4EMEN1ALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL14735153 | 0.69 | ALDH1A1 (0.43) | KDM4EMEN1ALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL5111763 | 0.69 | HTR3A (0.39) | KDM4EKMT2AKCNH2HTR3ACHRNA7 | |
| SCHEMBL38663142 | 0.69 | KDM4E (0.43) | KDM4EMEN1ALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL504169 | 0.68 | HTR3A (0.52) | KCNH2HTR3ACHRNA7 | |
| SCHEMBL27869429 | 0.68 | KDM4E (0.42) | KDM4EMEN1ALDH1A1CYP1A2CYP3A4 | |
| Hydrochloric Acid SCHEMBL11556609 | 0.68 | KDM4E (0.57) | KDM4EMEN1ALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL5111871 | 0.67 | KCNH2 (0.45) | KCNH2HTR3ACHRNA7CHRNB4CHRNA3 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1135389-B1 | 1,4-DIAZABICYCLO 3.2.2]NONANE DERIVATIVES, THEIR PREPARATION AND THERAPEUTIC APPLICATION | SANOFI SYNTHELABO (FR) | 2003-09-10 | — | — | EP | disclosed |
| US-6407095-B1 | TREATING NICOTINIC RECEPTOR, GASTROINTESTINAL, NERVOUS SYSTEM, PSYCHOLOGICAL, AND BRAIN DISORDERS | SANOFI-SYNTHELABO (FR) | 2002-06-18 | — | — | US | disclosed |