Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.44 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.44 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.44 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | MGLL | Q99685 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 6/20 | 0.41 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | CRHBP | P24387 | 1/20 | 0.40 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | BCL9 | O00512 | 1/20 | 0.39 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL7912761 | 0.77 | ALDH1A1 (0.50) | ALDH1A1HDAC3HDAC1HDAC2POLB | |
| SCHEMBL7919852 | 0.77 | ALDH1A1 (0.50) | ALDH1A1HDAC3HDAC1HDAC2POLB | |
| SCHEMBL846486 | 0.76 | ALDH1A1 (0.49) | ALDH1A1HDAC3HDAC1HDAC2POLB | |
| SCHEMBL3663774 | 0.75 | HSP90AA1 (0.45) | ALDH1A1HTT | |
| SCHEMBL11225018 | 0.75 | HSP90AA1 (0.45) | ALDH1A1HTT | |
| SCHEMBL2299570 | 0.75 | HSP90AA1 (0.45) | ALDH1A1HTT | |
| SCHEMBL3660417 | 0.75 | HSP90AA1 (0.45) | ALDH1A1HTT | |
| SCHEMBL3847845 | 0.75 | HSP90AA1 (0.45) | ALDH1A1HTT | |
| SCHEMBL8743943 | 0.74 | CNR2 (0.49) | ALDH1A1HDAC3HDAC1HDAC2POLB | |
| SCHEMBL7921449 | 0.73 | HDAC3 (0.49) | ALDH1A1HDAC3HDAC1HDAC2POLB |
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 |
|---|---|---|---|---|---|---|---|
| US-10655153-B2 | Chemoenzymatic synthesis of peptide beta-lactones and beta-hydroxy acids | WASHINGTON UNIVERSITY (US) | 2020-05-19 | — | — | US | disclosed |
| US-20180265905-A1 | CHEMOENZYMATIC SYNTHESIS OF PEPTIDE BETA-LACTONES AND BETA-HYDROXY ACIDS | WASHINGTON UNIVERSITY (US) | 2018-09-20 | — | — | US | disclosed |