Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 5/20 | 0.75 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.58 |
| ▸ | ESR1 | P03372 | 1/20 | 0.57 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.57 |
| ▸ | MAPT | P10636 | 3/20 | 0.57 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.57 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.57 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.55 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.54 |
| ▸ | CXCL12 | P48061 | 1/20 | 0.53 |
| ▸ | MAOB | P27338 | 3/20 | 0.52 |
| ▸ | MAOA | P21397 | 1/20 | 0.52 |
| ▸ | P4HB | P07237 | 1/20 | 0.51 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | USP2 | O75604 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
| ▸ | POLB | P06746 | 1/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.49 |
| ▸ | RECQL | P46063 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL30837247 | 0.86 | CYP3A4 (0.75) | CYP3A4CYP1B1ABCG2CXCL12MAOB | |
| SCHEMBL30837209 | 0.85 | CYP3A4 (0.74) | CYP3A4MAPTCYP1B1ABCG2MAOB | |
| SCHEMBL31574486 | 0.83 | CYP3A4 (0.71) | CYP3A4MAPTCYP1B1ABCG2MAOB | |
| SCHEMBL31574463 | 0.82 | CYP3A4 (0.70) | CYP3A4MAPTCYP1B1ABCG2CXCL12 | |
| SCHEMBL31574523 | 0.82 | CYP3A4 (0.74) | CYP3A4MAPTABCG2CXCL12MEN1 | |
| SCHEMBL31574561 | 0.82 | CYP3A4 (0.70) | CYP3A4CYP1B1ABCG2CXCL12MAOB | |
| SCHEMBL31574532 | 0.82 | CYP3A4 (1.00) | CYP3A4MAPTCYP1B1ABCG2CXCL12 | |
| SCHEMBL30837219 | 0.82 | CYP3A4 (0.70) | CYP3A4CYP1B1ABCG2CXCL12MAOB | |
| SCHEMBL30837164 | 0.82 | CYP3A4 (0.70) | CYP3A4CYP1B1ABCG2CXCL12MAOB | |
| SCHEMBL30837155 | 0.82 | CYP3A4 (0.74) | CYP3A4MAPTABCG2CXCL12MEN1 |
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-119998272-A | Methanogen inhibitors | 阿格里泽伦茨有限合伙公司 | 2025-05-13 | — | — | CN | disclosed |