Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPARA | Q07869 | 4/20 | 0.55 |
| ▸ | TSHR | P16473 | 2/20 | 0.55 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.55 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.55 |
| ▸ | HTR2A | P28223 | 1/20 | 0.55 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.55 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.50 |
| ▸ | MMP8 | P22894 | 1/20 | 0.48 |
| ▸ | PPARG | P37231 | 4/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.47 |
| ▸ | FBP1 | P09467 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | RECQL | P46063 | 1/20 | 0.44 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | CRHBP | P24387 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL2824491 | 0.88 | PPARA (0.71) | PPARATSHRABCB11CYP1A2CYP3A4 | |
| Phenol SCHEMBL4706535 | 0.82 | PPARA (0.63) | PPARATSHRABCB11CYP1A2CYP3A4 | |
| SCHEMBL28230446 | 0.81 | PIN1 (0.49) | PPARATSHRABCB11CYP1A2CYP3A4 | |
| SCHEMBL11358611 | 0.81 | OPRK1 (0.63) | PPARATSHRABCB11CYP1A2CYP3A4 | |
| SCHEMBL8468475 | 0.80 | KCNN4 (0.50) | PPARATSHRCYP1A2CYP3A4PPARG | |
| SCHEMBL28644949 | 0.80 | KCNN4 (0.50) | PPARATSHRCYP1A2CYP3A4PPARG | |
| SCHEMBL12913900 | 0.80 | PPARA (0.49) | PPARATSHRABCB11CYP1A2CYP3A4 | |
| SCHEMBL24497220 | 0.79 | POLB (0.50) | PPARATSHRABCB11CYP1A2CYP3A4 | |
| SCHEMBL27352386 | 0.79 | TSHR (0.51) | PPARATSHRABCB11CYP1A2CYP3A4 | |
| SCHEMBL6377517 | 0.79 | NPC1 (0.54) | PPARATSHRABCB11CYP1A2CYP3A4 |
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-4767880-A | WITH ALKALI METAL ALCOHOLATE, PHENOLATE, HYDROXYPHENOXYPROPIONATE OR HYDROQUINONE SALT | HOECHST AKTIENGESELLSCHAFT (DE) | 1988-08-30 | — | — | US | disclosed |