Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | GPR183 | P32249 | 7/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
| ▸ | AR | P10275 | 3/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL30737566 | 0.81 | CECR2 (0.41) | GAAGPR183TSHRMEN1LMNA | |
| SCHEMBL30737654 | 0.76 | HPGD (0.56) | TSHRMEN1LMNAKMT2AALDH1A1 | |
| SCHEMBL30737599 | 0.76 | HPGD (0.61) | TSHRMEN1LMNAKMT2AALDH1A1 | |
| SCHEMBL30737498 | 0.75 | HPGD (0.65) | TSHRMEN1LMNAKMT2AALDH1A1 | |
| SCHEMBL30737764 | 0.73 | ACACB (0.47) | GPR183TSHRCYP3A4ALDH1A1HPGD | |
| SCHEMBL395103 | 0.73 | GSK3B (0.48) | GAAMEN1KMT2ACYP3A4ALDH1A1 | |
| SCHEMBL11770219 | 0.66 | CYP19A1 (0.57) | GAALMNAALDH1A1PKMHPGD | |
| SCHEMBL14918493 | 0.66 | TSHR (0.52) | TSHRALDH1A1 | |
| SCHEMBL1568921 | 0.65 | GSK3B (0.57) | GAALMNAALDH1A1HPGD | |
| SCHEMBL3659298 | 0.65 | TPMT (0.46) | GAAMEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| CN-117510505-A | Pyrimidopyrazoles derivatives and their use in medicine | 中国药科大学 | 2024-02-06 | — | — | CN | disclosed |