Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 4/20 | 0.58 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.58 |
| ▸ | HPGD | P15428 | 2/20 | 0.58 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.58 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.58 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.58 |
| ▸ | EPHX1 | P07099 | 3/20 | 0.57 |
| ▸ | POLB | P06746 | 1/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.55 |
| ▸ | TSHR | P16473 | 1/20 | 0.55 |
| ▸ | MMP2 | P08253 | 1/20 | 0.54 |
| ▸ | MMP9 | P14780 | 1/20 | 0.54 |
| ▸ | MMP8 | P22894 | 1/20 | 0.54 |
| ▸ | MMP12 | P39900 | 1/20 | 0.54 |
| ▸ | MMP14 | P50281 | 1/20 | 0.54 |
| ▸ | NPC1 | O15118 | 2/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.51 |
| ▸ | LMNA | P02545 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL1520891 | 0.81 | RAB9A (0.53) | RAB9AEPHX2HPGDCYP3A4CYP2C19 | |
| SCHEMBL14310488 | 0.81 | RAB9A (0.56) | RAB9AEPHX2HPGDCYP3A4CYP2C19 | |
| SCHEMBL4494539 | 0.77 | ALDH1A1 (0.57) | RAB9AEPHX2HPGDKDM4ECYP3A4 | |
| SCHEMBL13544551 | 0.77 | HPGD (0.50) | RAB9AEPHX2HPGDCYP3A4CYP2C19 | |
| SCHEMBL13169536 | 0.76 | EPHX2 (0.83) | RAB9AEPHX2HPGDCYP2C19EPHX1 | |
| SCHEMBL3455859 | 0.76 | EPHX2 (0.83) | RAB9AEPHX2HPGDCYP2C19EPHX1 | |
| SCHEMBL4501570 | 0.75 | ALDH1A1 (0.56) | RAB9AHPGDKDM4ECYP3A4CYP2C19 | |
| SCHEMBL3153981 | 0.75 | HDAC1 (0.54) | KDM4E | |
| SCHEMBL7168651 | 0.75 | EPHX2 (0.62) | RAB9AEPHX2HPGDEPHX1POLB | |
| SCHEMBL13544820 | 0.74 | RAB9A (0.51) | RAB9AEPHX2HPGDCYP3A4CYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| US-6566375-B1 | For therapy of atherosclerosis | WYETH | 2003-05-20 | — | — | US | disclosed |
| US-6316467-B1 | Elevation of HDL cholesterol by 4-[(Aminothioxomethyl)-hydrazono]-N-(substituted)-4-arylbutanamides | AMERICAN HOME PRODUCTS CORPORATION | 2001-11-13 | — | — | US | disclosed |
| WO-1999025682-A1 | ELEVATION OF HDL CHOLESTEROL BY 4-[(AMINOTHIOXOMETHYL) -HYDRAZONO] -N-(SUBSTITUTED) -4-ARYLBUTANAMIDES | AMERICAN HOME PRODUCTS CORPORATION (US) | 1999-05-27 | — | — | WO | disclosed |