Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.48 |
| ▸ | SOAT1 | P35610 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.34 |
| ▸ | MGAM | O43451 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | SI | P14410 | 1/20 | 0.34 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.32 |
| ▸ | UGT2B7 | P16662 | 2/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL6898926 | 0.96 | ALDH1A1 (0.48) | ALDH1A1SOAT1LMNASMN1; SMN2HSD17B10 | |
| SCHEMBL10087948 | 0.94 | ALDH1A1 (0.46) | ALDH1A1SOAT1LMNASMN1; SMN2HSD17B10 | |
| SCHEMBL13457064 | 0.91 | ALDH1A1 (0.52) | ALDH1A1SOAT1LMNAHSD17B10ALOX15 | |
| SCHEMBL4628878 | 0.82 | ALDH1A1 (0.43) | ALDH1A1SOAT1LMNAHSD17B10ALOX15 | |
| SCHEMBL8857350 | 0.80 | CYP19A1 (0.37) | ALDH1A1LMNACYP19A1MEN1KMT2A | |
| SCHEMBL12789453 | 0.80 | TSHR (0.47) | ALDH1A1LMNASMN1; SMN2GAAMEN1 | |
| SCHEMBL8857138 | 0.79 | CYP19A1 (0.40) | ALDH1A1LMNASMN1; SMN2HSD17B10CYP19A1 | |
| SCHEMBL12987317 | 0.78 | CYP19A1 (0.38) | CYP19A1 | |
| SCHEMBL15252891 | 0.78 | ALDH1A1 (0.46) | ALDH1A1SOAT1LMNAHSD17B10ALOX15 | |
| SCHEMBL12334688 | 0.78 | ALDH1A1 (0.46) | ALDH1A1SOAT1LMNASMN1; SMN2HSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| US-8445476-B2 | Carbacephem β-lactam antibiotics | ACHAOGEN, INC. (US) | 2013-05-21 | — | — | US | disclosed |