Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 3/20 | 0.67 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.55 |
| ▸ | HPGD | P15428 | 4/20 | 0.55 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.55 |
| ▸ | POLB | P06746 | 2/20 | 0.55 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.55 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.55 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.55 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.55 |
| ▸ | CLK2 | P49760 | 1/20 | 0.55 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.55 |
| ▸ | TOP1 | P11387 | 7/20 | 0.54 |
| ▸ | LMNA | P02545 | 2/20 | 0.51 |
| ▸ | ATM | Q13315 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL6167085 | 1.00 | KCNH2 (0.67) | KCNH2CYP3A4KDM4EALDH1A1HPGD | |
| SCHEMBL6168710 | 0.91 | KCNH2 (0.57) | KCNH2CYP3A4KDM4EALDH1A1HPGD | |
| SCHEMBL27515036 | 0.91 | KCNH2 (0.57) | KCNH2CYP3A4KDM4EALDH1A1HPGD | |
| SCHEMBL5546283 | 0.89 | KCNH2 (0.73) | KCNH2CYP3A4KDM4EALDH1A1HPGD | |
| SCHEMBL6958823 | 0.87 | CYP3A4 (0.74) | KCNH2CYP3A4KDM4EALDH1A1HPGD | |
| SCHEMBL6163513 | 0.85 | CYP3A4 (0.50) | KCNH2CYP3A4KDM4EALDH1A1HPGD | |
| SCHEMBL30626289 | 0.85 | KCNH2 (0.65) | KCNH2CYP3A4KDM4EALDH1A1HPGD | |
| SCHEMBL29080642 | 0.85 | KCNH2 (0.65) | KCNH2CYP3A4KDM4EALDH1A1HPGD | |
| SCHEMBL5236833 | 0.84 | CYP3A4 (0.65) | KCNH2CYP3A4KDM4EALDH1A1HPGD | |
| SCHEMBL5236827 | 0.84 | CYP3A4 (0.65) | KCNH2CYP3A4KDM4EALDH1A1HPGD |
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-1134219-B1 | CYCLOALKYL-SUBSTITUTED AMINOMETHYLPYRROLIDINE DERIVATIVES | DAIICHI SEIYAKU CO (JP) | 2005-06-15 | — | — | EP | disclosed |
| US-6573260-B1 | Antibiotics | DAIICHI PHARMACEUTICAL CO., LTD. (JP) | 2003-06-03 | — | — | US | disclosed |