Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRB | P10828 | 1/20 | 0.41 |
| ▸ | PKM | P14618 | 1/20 | 0.41 |
| ▸ | POLQ | O75417 | 5/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.40 |
| ▸ | MAPT | P10636 | 4/20 | 0.40 |
| ▸ | HPGD | P15428 | 4/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 3/20 | 0.39 |
| ▸ | NPC1 | O15118 | 2/20 | 0.39 |
| ▸ | PAX8 | Q06710 | 2/20 | 0.39 |
| ▸ | TP53 | P04637 | 2/20 | 0.39 |
| ▸ | GPX4 | P36969 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 3/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | JAK2 | O60674 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL18814886 | 0.83 | ALDH1A1 (0.50) | THRBPKMALDH1A1MAPTHPGD | |
| SCHEMBL20122042 | 0.81 | ALDH1A1 (0.30) | ALDH1A1 | |
| SCHEMBL21533848 | 0.78 | SIGMAR1 (0.32) | — | |
| SCHEMBL21301180 | 0.76 | ALDH1A1 (0.46) | ALDH1A1MAPTHPGDTP53MEN1 | |
| SCHEMBL11146473 | 0.74 | THRB (0.47) | THRBPKMPOLQALDH1A1MAPT | |
| SCHEMBL24207873 | 0.73 | POLQ (0.48) | THRBPKMPOLQALDH1A1MAPT | |
| SCHEMBL19596029 | 0.72 | DHODH (0.36) | ALDH1A1MAPTHPGDSMN1; SMN2RAB9A | |
| SCHEMBL11695595 | 0.72 | THRB (0.48) | THRBPKMPOLQALDH1A1MAPT | |
| SCHEMBL30301298 | 0.72 | CYP3A4 (0.56) | THRBPKMPOLQALDH1A1MAPT | |
| SCHEMBL9547612 | 0.71 | ALDH1A1 (0.57) | THRBPKMPOLQALDH1A1MAPT |
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-3036231-B1 | SUBSTITUTED PYRIMIDINE COMPOUNDS, COMPOSITIONS AND MEDICINAL APPLICATIONS THEREOF | JUBILANT BIOSYS LTD (IN) | 2020-02-26 | — | — | EP | disclosed |