Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 4/20 | 0.73 |
| ▸ | TOP1 | P11387 | 9/20 | 0.59 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.58 |
| ▸ | HPGD | P15428 | 3/20 | 0.58 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.58 |
| ▸ | POLB | P06746 | 1/20 | 0.58 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.58 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.58 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.58 |
| ▸ | CLK2 | P49760 | 1/20 | 0.58 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.58 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.58 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.53 |
| ▸ | LMNA | P02545 | 1/20 | 0.53 |
| ▸ | MEN1 | O00255 | 1/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.51 |
| ▸ | ATM | Q13315 | 1/20 | 0.51 |
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 | 0.89 | KCNH2 (0.67) | KCNH2TOP1KDM4EALDH1A1HPGD | |
| SCHEMBL6166236 | 0.89 | KCNH2 (0.67) | KCNH2TOP1KDM4EALDH1A1HPGD | |
| SCHEMBL29080642 | 0.88 | KCNH2 (0.65) | KCNH2TOP1KDM4EALDH1A1HPGD | |
| SCHEMBL30626289 | 0.88 | KCNH2 (0.65) | KCNH2TOP1KDM4EALDH1A1HPGD | |
| SCHEMBL16105050 | 0.85 | KCNH2 (1.00) | KCNH2TOP1KDM4EALDH1A1HPGD | |
| SCHEMBL6509658 | 0.85 | KCNH2 (1.00) | KCNH2TOP1KDM4EALDH1A1HPGD | |
| SCHEMBL6958823 | 0.85 | CYP3A4 (0.74) | KCNH2TOP1KDM4EALDH1A1HPGD | |
| Water SCHEMBL9773807 | 0.84 | KCNH2 (0.98) | KCNH2TOP1KDM4EALDH1A1HPGD | |
| SCHEMBL12427299 | 0.84 | KCNH2 (0.57) | KCNH2TOP1KDM4EALDH1A1HPGD | |
| SCHEMBL12427285 | 0.84 | KCNH2 (0.57) | KCNH2TOP1KDM4EALDH1A1HPGD |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1757598-A1 | SUBSTITUTED PYRROLIDINE DERIVATIVE | DAIICHI PHARMACEUTICAL CO., LTD. (JP) | 2007-02-28 | — | — | EP | disclosed |