Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.51 |
| ▸ | DUSP3 | P51452 | 1/20 | 0.51 |
| ▸ | PTPN5 | P54829 | 1/20 | 0.51 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.51 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | ESRRB | O95718 | 1/20 | 0.40 |
| ▸ | ESRRG | P62508 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | CHRM1 | P11229 | 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 | |
|---|---|---|---|---|
| SCHEMBL28755315 | 0.89 | CYP1A2 (0.47) | NPSR1CYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL27642342 | 0.85 | CYP2D6 (0.51) | ALDH1A1NPSR1CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL27641923 | 0.85 | CYP2D6 (0.45) | NPSR1CYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL27641919 | 0.83 | HPGD (0.51) | ALDH1A1NPSR1CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL10341917 | 0.82 | LMNA (0.48) | ALDH1A1NPSR1CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL27641937 | 0.80 | DUSP3 (0.56) | ALDH1A1DUSP3PTPN5PTPN11POLB | |
| SCHEMBL27622887 | 0.79 | ALDH1A1 (0.41) | ALDH1A1DUSP3PTPN5PTPN11POLB | |
| SCHEMBL10200555 | 0.76 | DUSP3 (0.69) | ALDH1A1DUSP3PTPN5PTPN11NPSR1 | |
| SCHEMBL10200570 | 0.76 | DUSP3 (0.69) | ALDH1A1DUSP3PTPN5PTPN11NPSR1 | |
| SCHEMBL27641920 | 0.76 | GAA (0.52) | ALDH1A1NPSR1CYP1A2CYP3A4CYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| CN-100335468-C | Diaryl amidine compound, its production, medicinal composition and use | DRUG INST CHINESE ACADEMY OF M (CN) | 2007-09-05 | — | — | CN | claimed |
| CN-1712398-A | Diaryl amidine compound, its production, medicinal composition and use | DRUG INST CHINESE ACADEMY OF M (CN) | 2005-12-28 | — | — | CN | claimed |