Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.54 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.48 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 3/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.45 |
| ▸ | MAOB | P27338 | 1/20 | 0.45 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.44 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.44 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.44 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.44 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.44 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.44 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.44 |
| ▸ | DRD1 | P21728 | 1/20 | 0.44 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.44 |
| ▸ | HTR2A | P28223 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL7260255 | 0.86 | ALDH1A1 (0.51) | KMT2AMEN1CYP3A4ALDH1A1CYP2D6 | |
| SCHEMBL15415069 | 0.82 | CYP2D6 (0.48) | KMT2AMEN1CYP3A4ALDH1A1CYP2D6 | |
| SCHEMBL71975 | 0.79 | CTDSP1 (0.49) | KMT2AMEN1OPRD1MAPTNPSR1 | |
| SCHEMBL17726461 | 0.79 | KMT2A (0.50) | KMT2AMEN1CYP3A4ALDH1A1CYP2D6 | |
| SCHEMBL4826291 | 0.75 | OPRM1 (0.47) | KMT2AMEN1CYP3A4ALDH1A1CYP2D6 | |
| SCHEMBL29785592 | 0.74 | OPRM1 (0.46) | KMT2AMEN1ALDH1A1CYP2D6OPRD1 | |
| SCHEMBL5280062 | 0.73 | ALDH1A1 (0.54) | KMT2AMEN1ALDH1A1OPRD1MAPT | |
| SCHEMBL5280064 | 0.73 | ALDH1A1 (0.54) | KMT2AMEN1ALDH1A1OPRD1MAPT | |
| SCHEMBL3131844 | 0.71 | OPRM1 (0.44) | KMT2AMEN1CYP3A4ALDH1A1CYP2D6 | |
| SCHEMBL20594076 | 0.71 | KMT2A (0.57) | KMT2AMEN1CYP3A4ALDH1A1CYP2D6 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114763357-B | Indolopyrimidine tricyclic compound and preparation method and application thereof | 中国科学院上海药物研究所 | 2024-06-18 | — | — | CN | disclosed |
| US-5936088-A | NERVOUS SYSTEM DISORDERS | NOVO NORDISK A/S (DK) | 1999-08-10 | — | — | US | disclosed |
| EP-0871627-A1 | NOVEL SUBSTITUTED AZACYCLIC OR AZABICYCLIC COMPOUNDS | NOVO NORDISK A/S (DK) | 1998-10-21 | — | — | EP | disclosed |
| WO-1997011073-A1 | NOVEL SUBSTITUTED AZACYCLIC OR AZABICYCLIC COMPOUNDS | NOVO NORDISK A/S (DK) | 1997-03-27 | — | — | WO | disclosed |