Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSS | P25774 | 6/20 | 0.62 |
| ▸ | KDM1A | O60341 | 3/20 | 0.56 |
| ▸ | CTSK | P43235 | 9/20 | 0.49 |
| ▸ | KCNH2 | Q12809 | 5/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | THRB | P10828 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | PKM | P14618 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | STAT6 | P42226 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL26199891 | 0.82 | KIF11 (0.46) | CTSSCTSKKDM4EALDH1A1MEN1 | |
| SCHEMBL9849371 | 0.78 | CTSS (0.51) | CTSSKDM1ACTSKKCNH2KDM4E | |
| SCHEMBL1904903 | 0.77 | CYP1A2 (0.53) | KDM4EALDH1A1MEN1CYP1A2CYP3A4 | |
| SCHEMBL9205171 | 0.77 | CYP11B2 (0.50) | CTSSKDM4EALDH1A1MAOB | |
| SCHEMBL9954071 | 0.77 | CTSS (1.00) | CTSSKDM1ACTSKKCNH2KDM4E | |
| SCHEMBL3751766 | 0.75 | KDM1A (0.56) | CTSSKDM1AKDM4EALDH1A1MEN1 | |
| SCHEMBL6837458 | 0.75 | KDM1A (0.70) | CTSSKDM1AKDM4EALDH1A1MEN1 | |
| SCHEMBL3873916 | 0.75 | CTSK (0.65) | CTSSCTSKKCNH2CYP1A2CYP3A4 | |
| SCHEMBL12382082 | 0.75 | ALDH1A1 (0.64) | CTSSCTSKKDM4EALDH1A1NPSR1 | |
| SCHEMBL6236184 | 0.74 | CTSS (0.57) | CTSSKDM1ACTSKKCNH2KDM4E |
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-0446604-A2 | Pyridine and related aza heterocycle derivatives as cardiovascular agents | AMERICAN CYANAMID COMPANY (US) | 1991-09-18 | — | — | EP | disclosed |