Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.35 |
| ▸ | BRCA1 | P38398 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 2/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | SLC5A2 | P31639 | 4/20 | 0.32 |
| ▸ | SLC5A1 | P13866 | 3/20 | 0.32 |
| ▸ | HTR7 | P34969 | 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 | |
|---|---|---|---|---|
| SCHEMBL9925856 | 0.77 | ALDH1A1 (0.36) | ALDH1A1MAPTNPC1RAB9AMAPK1 | |
| SCHEMBL13952182 | 0.76 | ALDH1A1 (0.40) | ALDH1A1MAPTNPC1RAB9AMAPK1 | |
| SCHEMBL9925838 | 0.75 | MAOA (0.45) | RAB9ASMN1; SMN2MEN1ALOX12KMT2A | |
| SCHEMBL13618750 | 0.69 | ALDH1A1 (0.36) | ALDH1A1MAPTNPC1RAB9AMAPK1 | |
| SCHEMBL21182935 | 0.66 | ALDH1A1 (0.37) | ALDH1A1MAPTKDM4EMEN1HPGD | |
| SCHEMBL4321926 | 0.63 | SPHK1 (0.50) | POLBTP53 | |
| SCHEMBL10690315 | 0.63 | TSHR (0.48) | ALDH1A1MAPTKDM4EMEN1HPGD | |
| SCHEMBL10690318 | 0.63 | TSHR (0.48) | ALDH1A1MAPTKDM4EMEN1HPGD | |
| SCHEMBL14394336 | 0.63 | SLC6A2 (0.34) | ALDH1A1MAPTNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL36295 | 0.63 | TP53 (0.67) | ALDH1A1MAPK1SMN1; SMN2TAAR1TP53 |
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-1618087-B1 | ANTIBACTERIAL AGENTS | NOVARTIS VACCINES & DIAGNOSTIC (US) | 2012-06-13 | — | — | EP | disclosed |
| EP-2295402-A2 | Antibacterial agents | The University of Washington (US) | 2011-03-16 | — | — | EP | disclosed |