Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.52 |
| ▸ | TP53 | P04637 | 1/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.50 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.48 |
| ▸ | SRD5A2 | P31213 | 4/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | CA1 | P00915 | 2/20 | 0.44 |
| ▸ | CA2 | P00918 | 2/20 | 0.44 |
| ▸ | CA12 | O43570 | 1/20 | 0.44 |
| ▸ | CA3 | P07451 | 1/20 | 0.44 |
| ▸ | TYR | P14679 | 1/20 | 0.44 |
| ▸ | DRD1 | P21728 | 1/20 | 0.44 |
| ▸ | CA4 | P22748 | 1/20 | 0.44 |
| ▸ | CA6 | P23280 | 1/20 | 0.44 |
| ▸ | CA5A | P35218 | 1/20 | 0.44 |
| ▸ | CA7 | P43166 | 1/20 | 0.44 |
| ▸ | CA9 | Q16790 | 1/20 | 0.44 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.44 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL2914385 | 0.83 | TSHR (0.48) | TSHRTP53SMN1; SMN2ALOX15SRD5A2 | |
| SCHEMBL9696719 | 0.83 | ALDH1A1 (0.41) | SMN1; SMN2CA1CA2ALDH1A1MEN1 | |
| SCHEMBL8179270 | 0.81 | CA1 (0.43) | SMN1; SMN2CA1CA2CA12CA3 | |
| SCHEMBL9695086 | 0.81 | PARP10 (0.43) | TSHRSMN1; SMN2CA1CA2ALDH1A1 | |
| SCHEMBL10876734 | 0.80 | PLA2G4B (0.53) | TSHRTP53SMN1; SMN2ALOX15HTT | |
| SCHEMBL504032 | 0.78 | HTT (0.55) | TSHRTP53SMN1; SMN2ALOX15SRD5A2 | |
| SCHEMBL8179454 | 0.78 | SMN1; SMN2 (0.33) | SMN1; SMN2HTTALDH1A1MAPT | |
| SCHEMBL5441804 | 0.78 | FFAR1 (0.65) | TSHRTP53SMN1; SMN2ALOX15SRD5A2 | |
| SCHEMBL9696902 | 0.78 | MAPT (0.57) | CA1CA2CA9ALDH1A1KDM4E | |
| SCHEMBL1018288 | 0.77 | CA2 (0.52) | TSHRTP53SMN1; SMN2ALOX15SRD5A2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0481511-A2 | Antibiotic C-3 dithioacetal-substituted carbapenem compounds, compositions, and use thereof | Bristol-Myers Squibb Company (US) | 1992-04-22 | — | — | EP | disclosed |