Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.53 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.46 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.42 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.42 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.42 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.42 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.42 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.42 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.42 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.42 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.42 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.42 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.42 |
| ▸ | ACP1 | P24666 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | CASP6 | P55212 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | CSNK1D | P48730 | 5/20 | 0.40 |
| ▸ | ITK | Q08881 | 2/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL30450317 | 1.00 | ALDH1A1 (0.53) | ALDH1A1DYRK1AHDAC3HDAC4HDAC1 | |
| SCHEMBL25259129 | 1.00 | ALDH1A1 (0.53) | ALDH1A1DYRK1AHDAC3HDAC4HDAC1 | |
| SCHEMBL30450379 | 0.88 | ALDH1A1 (0.55) | ALDH1A1DYRK1AACP1POLBCSNK1D | |
| SCHEMBL25307365 | 0.88 | ALDH1A1 (0.55) | ALDH1A1DYRK1AACP1POLBCSNK1D | |
| SCHEMBL30451400 | 0.87 | ALDH1A1 (0.58) | ALDH1A1DYRK1APOLBCASP6TDP1 | |
| SCHEMBL25299150 | 0.87 | ALDH1A1 (0.58) | ALDH1A1DYRK1APOLBCASP6TDP1 | |
| SCHEMBL25834103 | 0.87 | ALDH1A1 (0.58) | ALDH1A1DYRK1APOLBCASP6TDP1 | |
| SCHEMBL25304740 | 0.86 | ALDH1A1 (0.63) | ALDH1A1DYRK1AHDAC3HDAC4HDAC1 | |
| SCHEMBL30450222 | 0.84 | ALDH1A1 (0.60) | ALDH1A1DYRK1AHDAC3HDAC4HDAC1 | |
| SCHEMBL25304574 | 0.84 | ALDH1A1 (0.60) | ALDH1A1DYRK1AHDAC3HDAC4HDAC1 |
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-2023131649-A1 | BENZOTHIAZOLE ANAOLOGUES AND USE THEREOF AS BOOSTERS OF ANTI TUBERCULOSIS DRUGS | INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (INSERM) (FR) | 2023-07-13 | — | — | WO | disclosed |