Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | PARP1 | P09874 | 3/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | SRC | P12931 | 4/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | PDPK1 | O15530 | 3/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | BCL2 | P10415 | 1/20 | 0.33 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.33 |
| ▸ | CA12 | O43570 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | CA9 | Q16790 | 1/20 | 0.33 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.32 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL856432 | 0.72 | ALDH1A1 (0.39) | ALDH1A1PARP1TSHRNPSR1CHEK1 | |
| SCHEMBL15864201 | 0.68 | ALDH1A1 (0.39) | ALDH1A1PARP1TSHRNPSR1CHEK1 | |
| SCHEMBL3131369 | 0.68 | ALDH1A1 (0.30) | ALDH1A1TSHRNPSR1CHEK1HTT | |
| Hydrochloric Acid SCHEMBL8486646 | 0.65 | SRC (0.37) | ALDH1A1PARP1TSHRNPSR1CHEK1 | |
| SCHEMBL3678768 | 0.64 | ALDH1A1 (0.35) | ALDH1A1PARP1TSHRNPSR1CHEK1 | |
| SCHEMBL3675974 | 0.64 | ALDH1A1 (0.35) | ALDH1A1PARP1TSHRNPSR1CHEK1 | |
| SCHEMBL1073971 | 0.64 | — | — | |
| SCHEMBL15416608 | 0.62 | SRC (0.35) | ALDH1A1NPSR1SRCEGFR | |
| SCHEMBL15864203 | 0.61 | SRC (0.40) | ALDH1A1PARP1TSHRNPSR1CHEK1 | |
| SCHEMBL14309113 | 0.60 | SRC (0.42) | ALDH1A1PARP1TSHRNPSR1CHEK1 |
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-3230467-A1 | METHODS AND COMPOSITIONS FOR DETECTING ANTIBIOTIC RESISTANT BACTERIA | ELITechGroup B.V. (NL) | 2017-10-18 | — | — | EP | claimed |
| WO-2016094162-A1 | METHODS AND COMPOSITIONS FOR DETECTING ANTIBIOTIC RESISTANT BACTERIA | ELITECHGROUP B.V. (NL) | 2016-06-16 | — | — | WO | claimed |