Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.42 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.42 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.42 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.42 |
| ▸ | HDAC4 | P56524 | 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 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.42 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.42 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.42 |
| ▸ | ERCC1 | P07992 | 1/20 | 0.41 |
| ▸ | ERCC4 | Q92889 | 1/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL13946682 | 0.83 | SMN1; SMN2 (0.58) | ALDH1A1L3MBTL1HDAC1HDAC6SMN1; SMN2 | |
| SCHEMBL7961750 | 0.81 | CHRNA7 (0.56) | ALDH1A1SMN1; SMN2MEN1KMT2A | |
| SCHEMBL11490206 | 0.81 | L3MBTL1 (0.64) | ALDH1A1SIGMAR1L3MBTL1MEN1KMT2A | |
| SCHEMBL10399987 | 0.79 | L3MBTL1 (0.67) | KDM4EALDH1A1L3MBTL1ERCC1ERCC4 | |
| SCHEMBL7956397 | 0.78 | CHRNA7 (0.56) | ALDH1A1SMN1; SMN2MEN1KMT2A | |
| SCHEMBL17479608 | 0.76 | CHRNA7 (0.55) | ALDH1A1SMN1; SMN2MEN1KMT2A | |
| SCHEMBL22743960 | 0.75 | GAA (0.54) | KDM4EALDH1A1SIGMAR1HDAC1HDAC6 | |
| SCHEMBL28896233 | 0.74 | SLC6A4 (0.40) | SIGMAR1HDAC1HDAC6SMN1; SMN2HRH3 | |
| SCHEMBL29483480 | 0.74 | HDAC1 (0.63) | KDM4EALDH1A1L3MBTL1HDAC1HDAC6 | |
| SCHEMBL4357989 | 0.74 | HDAC1 (0.63) | KDM4EALDH1A1L3MBTL1HDAC1HDAC6 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3227294-A1 | 1-[2-(AMINOMETHYL)BENZYL]-2-THIOXO-1,2,3,5-TETRAHYDRO-4H-PYRROLO[3,2-D]PYRIMIDIN-4-ONES AS INHIBITORS OF MYELOPEROXIDASE | Astrazeneca AB (SE) | 2017-10-11 | — | — | EP | disclosed |
| WO-2016087338-A1 | 1-[2-(AMINOMETHYL)BENZYL]-2-THIOXO-1,2,3,5-TETRAHYDRO-4H-PYRROLO[3,2-D]PYRIMIDIN-4-ONES AS INHIBITORS OF MYELOPEROXIDASE | ASTRAZENECA AB (SE) | 2016-06-09 | — | — | WO | disclosed |