Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 8/20 | 0.64 |
| ▸ | TACR1 | P25103 | 2/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | THPO | P40225 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.44 |
| ▸ | MAOA | P21397 | 2/20 | 0.40 |
| ▸ | MAOB | P27338 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | AGXT | P21549 | 4/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL7892498 | 0.82 | IDO1 (0.69) | IDO1TACR1CYP1A2CYP2D6CYP2C19 | |
| SCHEMBL24759853 | 0.80 | IDO1 (0.67) | IDO1TACR1CYP1A2CYP2D6CYP2C19 | |
| SCHEMBL172923 | 0.78 | IDO1 (1.00) | IDO1AGXTCYP3A4 | |
| SCHEMBL3154502 | 0.78 | IDO1 (0.64) | IDO1TACR1CYP1A2CYP2D6CYP2C19 | |
| SCHEMBL15687841 | 0.77 | TSHR (0.62) | IDO1TACR1CYP1A2CYP2D6CYP2C19 | |
| SCHEMBL13188027 | 0.77 | IDO1 (0.62) | IDO1TACR1CYP1A2CYP2D6CYP2C19 | |
| Hydrochloric Acid SCHEMBL1715070 | 0.77 | IDO1 (1.00) | IDO1AGXTCYP3A4 | |
| SCHEMBL27582492 | 0.77 | IDO1 (0.62) | IDO1TACR1CYP1A2CYP2D6CYP2C19 | |
| SCHEMBL28768660 | 0.77 | — | — | |
| SCHEMBL3156094 | 0.75 | IDO1 (0.60) | IDO1TACR1CYP1A2CYP2D6CYP2C19 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101070316-A | Diaryl acid derivatives as PPAR receptor ligands | AVENTIS PHARMA GMBH (DE) | 2007-11-14 | — | — | CN | disclosed |
| CN-1331862-C | Diaryl acid derivatives as PPAR receptor ligands | AVENTIS PHARAMCEUTICALS PRODUC (DE) | 2007-08-15 | — | — | CN | disclosed |
| CN-1349525-A | Diaryl acid derivatives as PPAR receptor ligands | AVENTIS PHARAMCEUTICALS PRODUC (BE) | 2002-05-15 | — | — | CN | disclosed |