Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TLR4 | O00206 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | HTT | P42858 | 2/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | ALDH1A3 | P47895 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL20788571 | 0.88 | MAPT (0.33) | TLR4ALDH1A1MAPTHTTCYP1A2 | |
| SCHEMBL20764486 | 0.77 | ALDH1A1 (0.34) | TLR4ALDH1A1MAPTCYP1A2CYP3A4 | |
| SCHEMBL20787606 | 0.71 | SMN1; SMN2 (0.43) | ALDH1A1MAPTHTTCYP1A2CYP3A4 | |
| SCHEMBL23748164 | 0.65 | HTR2C (0.39) | TLR4ALDH1A1HTT | |
| SCHEMBL30593089 | 0.65 | ALDH1A1 (0.46) | TLR4ALDH1A1HTTCYP1A2CYP3A4 | |
| SCHEMBL23748226 | 0.65 | ALDH1A1 (0.46) | TLR4ALDH1A1HTTCYP1A2CYP3A4 | |
| SCHEMBL15956251 | 0.64 | ALDH1A1 (0.42) | TLR4ALDH1A1MAPTHTTCYP1A2 | |
| SCHEMBL3944635 | 0.63 | HPGD (0.49) | ALDH1A1HTTCYP3A4KDM4EPOLB | |
| SCHEMBL4780536 | 0.63 | HPGD (0.46) | TLR4ALDH1A1MAPTHTTLMNA | |
| SCHEMBL14172740 | 0.63 | KDM4E (0.60) | ALDH1A1HTTLMNAKDM4EPOLB |
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 |
|---|---|---|---|---|---|---|---|
| WO-2019038405-A1 | NOVEL CYSTOBACTAMIDE DERIVATIVES | Helmholtz-Zentrum für Infektionsforschung GmbH (DE) | 2019-02-28 | — | — | WO | disclosed |