Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM1A | O60341 | 14/20 | 0.53 |
| ▸ | RCOR1 | Q9UKL0 | 7/20 | 0.53 |
| ▸ | LIG1 | P18858 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | MAOB | P27338 | 6/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.41 |
| ▸ | KDM1B | Q8NB78 | 1/20 | 0.41 |
| ▸ | MAOA | P21397 | 4/20 | 0.40 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| Formaldehyde SCHEMBL28031926 | 0.94 | KDM1A (0.49) | KDM1ARCOR1LIG1TSHRHSD17B10 | |
| SCHEMBL4772628 | 0.80 | KDM1A (0.49) | KDM1ARCOR1LIG1TSHRHSD17B10 | |
| SCHEMBL4769316 | 0.80 | KDM1A (0.44) | KDM1ARCOR1LIG1TSHRHSD17B10 | |
| SCHEMBL20707753 | 0.78 | MAOB (0.45) | KDM1AMAOBKCNH2MAOACYP3A4 | |
| SCHEMBL23198894 | 0.77 | LIG1 (0.46) | KDM1ARCOR1LIG1TSHRHSD17B10 | |
| SCHEMBL20707778 | 0.76 | KDM1A (0.45) | KDM1ARCOR1MAOBMAOA | |
| SCHEMBL20707745 | 0.76 | KDM1A (0.45) | KDM1ARCOR1MAOBMAOA | |
| SCHEMBL38656156 | 0.76 | KDM1A (0.45) | KDM1ARCOR1MAOBMAOA | |
| SCHEMBL25212520 | 0.76 | KDM1A (0.45) | KDM1ARCOR1MAOBMAOA | |
| SCHEMBL4339855 | 0.76 | KDM1A (0.53) | KDM1ARCOR1LIG1MAOBMAOA |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110003110-B | Aryl beta-aminoketone compound and preparation method thereof | 南京工业大学 | 2022-09-06 | — | — | CN | claimed |
| WO-2024109919-A1 | PYRIDONE COMPOUND, PREPARATION METHOD THEREFOR AND USE THEREOF | 盛睿泽华医药科技（苏州）有限公司 | 2024-05-30 | — | — | WO | disclosed |
| CN-110003110-B | Aryl beta-aminoketone compound and preparation method thereof | 南京工业大学 | 2022-09-06 | — | — | CN | disclosed |
| EP-2888229-B1 | alpha7 NICOTINIC ACETYLCHOLINE RECEPTOR MODULATORS AND USES THEREOF | MERCK SHARP & DOHME (US) | 2019-02-06 | — | — | EP | disclosed |
| WO-2018089406-A1 | ROR GAMMA MODULATORS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2018-05-17 | — | — | WO | disclosed |