Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | NPC1 | O15118 | 2/20 | 0.46 |
| ▸ | RAB9A | P51151 | 2/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 2/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | CA1 | P00915 | 1/20 | 0.43 |
| ▸ | CA2 | P00918 | 1/20 | 0.43 |
| ▸ | CA7 | P43166 | 1/20 | 0.43 |
| ▸ | CA13 | Q8N1Q1 | 1/20 | 0.43 |
| ▸ | BDKRB1 | P46663 | 1/20 | 0.42 |
| ▸ | AURKA | O14965 | 1/20 | 0.41 |
| ▸ | EGFR | P00533 | 1/20 | 0.41 |
| ▸ | CNR1 | P21554 | 1/20 | 0.41 |
| ▸ | CNR2 | P34972 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL7751822 | 0.94 | BDKRB1 (0.46) | ALDH1A1CYP1A2CYP2D6CYP2C19HTT | |
| SCHEMBL7746182 | 0.91 | BDKRB1 (0.49) | ALDH1A1NPC1RAB9ACYP1A2CYP2D6 | |
| SCHEMBL7750817 | 0.88 | ALDH1A1 (0.52) | ALDH1A1POLBBDKRB1AURKAEGFR | |
| SCHEMBL7753157 | 0.85 | BDKRB1 (0.53) | ALDH1A1NPC1RAB9ASMN1; SMN2POLB | |
| SCHEMBL7746219 | 0.84 | PPARG (0.44) | ALDH1A1POLBTDP1BDKRB1EGFR | |
| SCHEMBL7752026 | 0.84 | SMN1; SMN2 (0.47) | NPC1RAB9AHTTSMN1; SMN2POLB | |
| SCHEMBL7752068 | 0.82 | BDKRB1 (0.44) | ALDH1A1HTTSMN1; SMN2CA1CA2 | |
| SCHEMBL7750841 | 0.81 | EGFR (0.52) | ALDH1A1NPC1SMN1; SMN2POLBBDKRB1 | |
| SCHEMBL7753138 | 0.80 | LTB4R2 (0.40) | ALDH1A1CYP1A2CYP2D6CYP2C19HTT | |
| SCHEMBL7753170 | 0.76 | GSK3B (0.48) | ALDH1A1HTTSMN1; SMN2POLBCA1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0686631-B1 | Pyrimidine derivatives and pharmaceutical compositions | KUREHA CHEMICAL IND CO LTD (JP) | 2001-01-17 | — | — | EP | disclosed |
| US-5585381-A | HYPOTENSIVE AGENT AND ALSO TREATING KIDNEY RENAL DISEASE | KUREHA CHEMICAL INDUSTRY CO., LTD. (JP) | 1996-12-17 | — | — | US | disclosed |
| EP-0686631-A1 | Pyrimidine derivatives and pharmaceutical composition | Kureha Chemical Industry Co., Ltd. (JP) | 1995-12-13 | — | — | EP | disclosed |