Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC8 | Q9BY41 | 6/20 | 0.44 |
| ▸ | POLB | P06746 | 2/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 3/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | GFER | P55789 | 1/20 | 0.41 |
| ▸ | NPFFR1 | Q9GZQ6 | 1/20 | 0.40 |
| ▸ | NPFFR2 | Q9Y5X5 | 1/20 | 0.40 |
| ▸ | TLR2 | O60603 | 1/20 | 0.39 |
| ▸ | TLR1 | Q15399 | 1/20 | 0.39 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.39 |
| ▸ | HTRA1 | Q92743 | 1/20 | 0.39 |
| ▸ | NAMPT | P43490 | 2/20 | 0.38 |
| ▸ | MMP2 | P08253 | 1/20 | 0.38 |
| ▸ | MMP9 | P14780 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL7726519 | 0.91 | POLB (0.42) | HDAC8POLBCYP1A2CYP3A4CYP2C19 | |
| SCHEMBL7731475 | 0.91 | HDAC8 (0.44) | HDAC8POLBCYP1A2CYP3A4CYP2C19 | |
| SCHEMBL7725703 | 0.89 | POLB (0.43) | HDAC8POLBCYP1A2CYP3A4CYP2C19 | |
| SCHEMBL7728188 | 0.89 | POLB (0.47) | HDAC8POLBCYP1A2CYP3A4CYP2C19 | |
| SCHEMBL7727250 | 0.88 | LTA4H (0.45) | HDAC8POLBNPC1 | |
| SCHEMBL7728407 | 0.88 | MEN1 (0.39) | HDAC8POLBCYP1A2CYP3A4CYP2C19 | |
| SCHEMBL7728411 | 0.88 | MEN1 (0.39) | HDAC8POLBCYP1A2CYP3A4CYP2C19 | |
| SCHEMBL7722104 | 0.86 | PABPC1 (0.45) | HDAC8POLBCYP1A2CYP3A4CYP2C19 | |
| SCHEMBL7728829 | 0.84 | SIRT2 (0.48) | HDAC8POLB | |
| SCHEMBL7729234 | 0.82 | HDAC4 (0.44) | HDAC8POLBCYP1A2CYP3A4CYP2C19 |
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-6399629-B1 | PYRROLIDINES AND PIPERIDINES FOR TREATING MICROBIAL INFECTIONS BY REDUCING EXPORT OF COADMINISTERED ANTIMICROBIAL AGENT OR COMPOUND SYNTHESIZED BY MICROBES FOR THEIR GROWTH; REDUCING IN VIVO AVAILABILITY | MICROCIDE PHARMACEUTICALS, INC. | 2002-06-04 | — | — | US | disclosed |