Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 3/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | CNR2 | P34972 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.33 |
| ▸ | USP2 | O75604 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL8437874 | 0.73 | KDM4E (0.39) | CYP3A4KMT2ASMN1; SMN2MEN1KDM4E | |
| SCHEMBL8437857 | 0.70 | PTGS2 (0.39) | CYP3A4SMN1; SMN2KDM4EHPGDCYP1A2 | |
| SCHEMBL8434025 | 0.68 | PTGS2 (0.48) | KMT2AMEN1KDM4EGAAMAPT | |
| SCHEMBL28662 | 0.66 | CYP3A4 (1.00) | CYP3A4NPSR1KMT2ASMN1; SMN2MEN1 | |
| SCHEMBL4622249 | 0.65 | CYP3A4 (0.46) | CYP3A4NPSR1KMT2ASMN1; SMN2MEN1 | |
| SCHEMBL8640814 | 0.65 | KMT2A (0.43) | CYP3A4NPSR1KMT2ASMN1; SMN2MEN1 | |
| SCHEMBL5391867 | 0.64 | CYP3A4 (0.45) | CYP3A4NPSR1KMT2ASMN1; SMN2MEN1 | |
| SCHEMBL9818017 | 0.64 | CASP3 (0.47) | CYP3A4KMT2ASMN1; SMN2MEN1KDM4E | |
| SCHEMBL10997976 | 0.62 | CYP3A4 (0.79) | CYP3A4NPSR1KMT2ASMN1; SMN2MEN1 | |
| SCHEMBL9246057 | 0.62 | CYP3A4 (0.76) | CYP3A4NPSR1KMT2ASMN1; SMN2MEN1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5889185-A | Method of synthesizing isoindolequinones and derivatives thereof | THE UNIVERSITY OF AKRON (US) | 1999-03-30 | — | — | US | disclosed |
| WO-1998046567-A1 | METHOD OF SYNTHESIZING ISOINDOLEQUINONES AND DERIVATIVES THEREOF | THE UNIVERSITY OF AKRON (US) | 1998-10-22 | — | — | WO | disclosed |