Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOTUM | Q6P988 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.50 |
| ▸ | LMNA | P02545 | 3/20 | 0.50 |
| ▸ | ESRRB | O95718 | 1/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 2/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.48 |
| ▸ | HTT | P42858 | 1/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 3/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | AKT1 | P31749 | 1/20 | 0.45 |
| ▸ | CD69 | Q07108 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 2/20 | 0.44 |
| ▸ | CA12 | O43570 | 1/20 | 0.43 |
| ▸ | CA7 | P43166 | 1/20 | 0.43 |
| ▸ | CA9 | Q16790 | 1/20 | 0.43 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL27324824 | 0.83 | NOTUM (0.49) | NOTUMALDH1A1LMNAESRRBKDM4E | |
| Anthracene SCHEMBL27792717 | 0.81 | ALDH1A1 (0.53) | ALDH1A1LMNAESRRBKDM4EMAPT | |
| Hydrochloric Acid SCHEMBL28284496 | 0.81 | NOTUM (0.48) | NOTUMALDH1A1LMNAKDM4EMAPT | |
| SCHEMBL7296197 | 0.81 | CD69 (0.41) | NOTUMKDM4EMAPTKMT2AMEN1 | |
| Indoline SCHEMBL9093000 | 0.80 | NOTUM (0.45) | NOTUMALDH1A1LMNAESRRBKDM4E | |
| Dimethyl Succinate SCHEMBL28606769 | 0.79 | TSHR (0.77) | ALDH1A1LMNAESRRBKDM4EMAPT | |
| SCHEMBL164072 | 0.79 | — | — | |
| Dimethyl Succinate SCHEMBL20335703 | 0.79 | TSHR (0.77) | ALDH1A1LMNAESRRBKDM4EMAPT | |
| Succinic Acid SCHEMBL18063898 | 0.79 | TSHR (0.77) | ALDH1A1LMNAESRRBKDM4EMAPT | |
| Dimethyl Succinate SCHEMBL29626086 | 0.79 | TSHR (0.77) | ALDH1A1LMNAESRRBKDM4EMAPT |
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-1991005763-A1 | DIPEPTIDE-ANALOG-BASED METALLOENDOPEPTIDASE INHIBITORS AND METHODS OF USING SAME | THE SALK INSTITUTE BIOTECHNOLOGY/INDUSTRIAL ASSOCIATES, INC. (US) | 1991-05-02 | — | — | WO | disclosed |