Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR2 | P34972 | 6/20 | 0.50 |
| ▸ | CNR1 | P21554 | 4/20 | 0.50 |
| ▸ | PPARG | P37231 | 2/20 | 0.50 |
| ▸ | PPARD | Q03181 | 2/20 | 0.50 |
| ▸ | PPARA | Q07869 | 2/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | MMP1 | P03956 | 1/20 | 0.45 |
| ▸ | MMP8 | P22894 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.44 |
| ▸ | GFPT1 | Q06210 | 1/20 | 0.43 |
| ▸ | CETP | P11597 | 1/20 | 0.43 |
| ▸ | FAAH | O00519 | 1/20 | 0.41 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL7890988 | 1.00 | CNR2 (0.50) | CNR2CNR1PPARGPPARDPPARA | |
| SCHEMBL7161352 | 0.89 | CNR2 (0.58) | CNR2CNR1PPARGPPARDPPARA | |
| SCHEMBL9570825 | 0.86 | GFPT1 (0.42) | CNR2CNR1PPARGPPARDPPARA | |
| SCHEMBL9570830 | 0.86 | GFPT1 (0.42) | CNR2CNR1PPARGPPARDPPARA | |
| SCHEMBL15272492 | 0.83 | CNR2 (0.48) | CNR2CNR1PPARGPPARDPPARA | |
| SCHEMBL9350622 | 0.81 | CYP2D6 (0.54) | CNR2CNR1PPARGPPARDPPARA | |
| SCHEMBL9350625 | 0.81 | CYP2D6 (0.54) | CNR2CNR1PPARGPPARDPPARA | |
| SCHEMBL15740340 | 0.81 | CYP2D6 (0.54) | CNR2CNR1PPARGPPARDPPARA | |
| SCHEMBL28682924 | 0.81 | GFPT1 (0.41) | CNR2CNR1PPARGPPARDPPARA | |
| SCHEMBL11466468 | 0.78 | CNR2 (0.62) | CNR2CNR1PPARGPPARDPPARA |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6177497-B1 | 2-ISOBUTOXYETHANOL IS ADDED TO THE AQUEOUS PHASE IN CONTACT WITH NATURAL GAS. | CLARIANT GMBH (DE) | 2001-01-23 | — | — | US | disclosed |