Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.38 |
| ▸ | HTT | P42858 | 3/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | BRD4 | O60885 | 1/20 | 0.35 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.34 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.34 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.34 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.34 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.34 |
| ▸ | DRD1 | P21728 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL6669438 | 0.84 | ALDH1A1 (0.40) | ALDH1A1HTTKDM4ESMN1; SMN2POLB | |
| SCHEMBL6691450 | 0.84 | CHRM2 (0.38) | ALDH1A1HTTSMN1; SMN2POLBMAPK1 | |
| SCHEMBL6647130 | 0.74 | EEF2K (0.37) | ALDH1A1SMN1; SMN2CYP2C9CYP2C19CHRM2 | |
| SCHEMBL6644175 | 0.74 | ALDH1A1 (0.44) | ALDH1A1HTTKDM4ESMN1; SMN2POLB | |
| SCHEMBL6673017 | 0.73 | MEN1 (0.34) | ALDH1A1KDM4ETSHRCYP1A2CHRM2 | |
| Hydrochloric Acid SCHEMBL7556675 | 0.73 | ALDH1A1 (0.43) | ALDH1A1HTTKDM4ESMN1; SMN2POLB | |
| SCHEMBL6644816 | 0.73 | ALDH1A1 (0.32) | ALDH1A1KDM4EPOLBPKMKCNH2 | |
| Hydrochloric Acid SCHEMBL7143673 | 0.73 | ALDH1A1 (0.32) | ALDH1A1HTTKDM4ESMN1; SMN2POLB | |
| SCHEMBL6669429 | 0.72 | CYP11B1 (0.38) | ALDH1A1HTTKDM4ESMN1; SMN2POLB | |
| SCHEMBL6672589 | 0.71 | ALDH1A1 (0.33) | ALDH1A1KDM4EPOLBTSHRCYP1A2 |
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-1401830-A2 | QUINAZOLINEDIONES AS ANTIBACTERIAL AGENTS | Warner-Lambert Company LLC (US) | 2004-03-31 | — | — | EP | disclosed |
| WO-2002102793-A2 | QUINAZOLINEDIONES AS ANTIBACTERIAL AGENTS | WARNER-LAMBERT COMPANY LLC (US) | 2002-12-27 | — | — | WO | disclosed |