Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PYGL | P06737 | 2/20 | 0.44 |
| ▸ | PPIB | P23284 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | DRD4 | P21917 | 1/20 | 0.36 |
| ▸ | ATF1 | P18846 | 1/20 | 0.36 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.36 |
| ▸ | GRM5 | P41594 | 1/20 | 0.36 |
| ▸ | TACR1 | P25103 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | POLQ | O75417 | 1/20 | 0.35 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.35 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.35 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.35 |
| ▸ | THRA | P10827 | 1/20 | 0.34 |
| ▸ | THRB | P10828 | 1/20 | 0.34 |
| ▸ | TPMT | P51580 | 1/20 | 0.34 |
| ▸ | FABP4 | P15090 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL18130476 | 0.80 | ALDH1A1 (0.49) | PYGLPPIBALDH1A1MEN1KMT2A | |
| SCHEMBL9824189 | 0.77 | ALDH1A1 (0.39) | PYGLALDH1A1ATF1NFKB1GRM5 | |
| SCHEMBL11394132 | 0.77 | ATF1 (0.40) | ALDH1A1DRD4ATF1NFKB1GRM5 | |
| SCHEMBL22289622 | 0.75 | GABRP (0.46) | ALDH1A1ATF1NFKB1TACR1POLQ | |
| SCHEMBL2092292 | 0.74 | TPMT (0.44) | ALDH1A1ATF1NFKB1TACR1NOTUM | |
| Hydrochloric Acid SCHEMBL29472280 | 0.74 | GABRP (0.46) | ALDH1A1ATF1NFKB1TACR1POLQ | |
| SCHEMBL22289651 | 0.73 | FOLH1 (0.46) | PYGLPPIBMEN1KMT2APOLQ | |
| SCHEMBL9358287 | 0.72 | LMNA (0.48) | ALDH1A1ATF1NFKB1GRM5KMT2A | |
| SCHEMBL22289627 | 0.71 | PPIB (0.61) | PPIBALDH1A1KMT2A | |
| SCHEMBL2092289 | 0.70 | ATF1 (0.43) | ALDH1A1ATF1NFKB1TACR1NOTUM |
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-3917627-A1 | ACETAMIDO DERIVATIVES AS DNA POLYMERASE THETA INHIBITORS | Ideaya Biosciences, Inc. (US) | 2021-12-08 | — | — | EP | disclosed |
| WO-2020160134-A1 | ACETAMIDO DERIVATIVES AS DNA POLYMERASE THETA INHIBITORS | IDEAYA BIOSCIENCES, INC. (US) | 2020-08-06 | — | — | WO | disclosed |