Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PYGL | P06737 | 5/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | FABP4 | P15090 | 6/20 | 0.38 |
| ▸ | FABP5 | Q01469 | 5/20 | 0.38 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | HTR1E | P28566 | 1/20 | 0.36 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 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 | |
|---|---|---|---|---|
| SCHEMBL8663533 | 1.00 | PYGL (0.39) | PYGLCYP2C9CYP3A4CYP2C19ALDH1A1 | |
| SCHEMBL8654879 | 1.00 | PYGL (0.39) | PYGLCYP2C9CYP3A4CYP2C19ALDH1A1 | |
| SCHEMBL8650594 | 0.99 | ALDH1A1 (0.39) | PYGLCYP2C9CYP3A4CYP2C19ALDH1A1 | |
| SCHEMBL8652690 | 0.86 | MAPT (0.41) | CYP2C9CYP3A4CYP2C19ALDH1A1ADRB2 | |
| SCHEMBL8654389 | 0.86 | MAPT (0.41) | CYP2C9CYP3A4CYP2C19ALDH1A1ADRB2 | |
| SCHEMBL8651995 | 0.86 | MAPT (0.41) | CYP2C9CYP3A4CYP2C19ALDH1A1ADRB2 | |
| SCHEMBL8657002 | 0.85 | HTR1E (0.36) | ALDH1A1NPSR1LMNASMN1; SMN2HTR1E | |
| SCHEMBL6475256 | 0.85 | FAAH (0.45) | NPSR1LMNA | |
| SCHEMBL6482748 | 0.85 | FAAH (0.45) | NPSR1LMNA | |
| SCHEMBL6475228 | 0.85 | FAAH (0.45) | NPSR1LMNA |
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-5847211-A | Substituted 1H-3-Aryl-pyrrolidine-2,4-dione derivatives | BAYER AKTIENGESELLSCHAFT (DE) | 1998-12-08 | — | — | US | disclosed |
| US-5622917-A | PESTICIDES | BAYER AKTIENGESELLSCHAFT (DE) | 1997-04-22 | — | — | US | disclosed |