Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 3/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | POLB | P06746 | 3/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | PGR | P06401 | 1/20 | 0.42 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.42 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.42 |
| ▸ | HTR2A | P28223 | 1/20 | 0.42 |
| ▸ | HRH1 | P35367 | 1/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.42 |
| ▸ | CPA1 | P15085 | 2/20 | 0.41 |
| ▸ | CPB1 | P15086 | 1/20 | 0.41 |
| ▸ | CPA3 | P15088 | 1/20 | 0.41 |
| ▸ | CPB2 | Q96IY4 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | PPARG | P37231 | 1/20 | 0.40 |
| ▸ | PPARA | Q07869 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 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 | |
|---|---|---|---|---|
| SCHEMBL6576148 | 0.83 | CYP2C19 (0.43) | CYP2C19ALDH1A1POLBCYP2C9SMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL8668132 | 0.82 | CYP2C19 (0.42) | CYP2C19ALDH1A1POLBCYP2C9SMN1; SMN2 | |
| SCHEMBL27878876 | 0.77 | CYP2C19 (0.46) | CYP2C19ALDH1A1POLBCYP2C9SMN1; SMN2 | |
| SCHEMBL27862584 | 0.76 | PPARG (0.48) | CYP2C19ALDH1A1POLBCYP2C9SMN1; SMN2 | |
| Ethylamine SCHEMBL11235220 | 0.73 | CYP2C19 (0.63) | CYP2C19ALDH1A1POLBCYP2C9SMN1; SMN2 | |
| SCHEMBL6467489 | 0.73 | CYP2C19 (0.46) | CYP2C19ALDH1A1POLBCYP2C9SMN1; SMN2 | |
| SCHEMBL7540831 | 0.73 | CYP2C19 (0.63) | CYP2C19ALDH1A1POLBCYP2C9SMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL6467921 | 0.71 | IDO1 (0.45) | CYP2C19ALDH1A1POLBCYP2C9SMN1; SMN2 | |
| SCHEMBL4016741 | 0.71 | PDPK1 (0.47) | CYP2C19CPA1CPB1CPA3CPB2 | |
| SCHEMBL6578366 | 0.71 | CYP2C19 (0.49) | CYP2C19ALDH1A1POLBSMN1; SMN2CPA3 |
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-0870762-B1 | NOVEL AMINO ACID DERIVATIVES HAVING N,N-DIALKYLAMINOPHENYL GROUP | SANTEN PHARMACEUTICAL CO LTD (JP) | 2004-04-28 | — | — | EP | disclosed |
| EP-0870762-A1 | NOVEL AMINO ACID DERIVATIVES HAVING N,N-DIALKYLAMINOPHENYL GROUP | SANTEN PHARMACEUTICAL CO., LTD. (JP) | 1998-10-14 | — | — | EP | disclosed |