Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 3/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.45 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.45 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.45 |
| ▸ | TRPV1 | Q8NER1 | 2/20 | 0.44 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.43 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.43 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.43 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.43 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.43 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.43 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.43 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.43 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 5/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL7722254 | 1.00 | POLB (0.46) | POLBCYP1A2CYP3A4CYP2C19EPHX2 | |
| SCHEMBL7726525 | 0.91 | POLB (0.56) | POLBCYP1A2CYP3A4CYP2C19EPHX2 | |
| SCHEMBL7728996 | 0.91 | POLB (0.56) | POLBCYP1A2CYP3A4CYP2C19EPHX2 | |
| SCHEMBL7728992 | 0.91 | POLB (0.56) | POLBCYP1A2CYP3A4CYP2C19EPHX2 | |
| SCHEMBL7729236 | 0.83 | HDAC4 (0.41) | POLBCYP1A2CYP3A4CYP2C19EPHX2 | |
| SCHEMBL7729234 | 0.81 | HDAC4 (0.44) | POLBCYP1A2CYP3A4CYP2C19EPHX2 | |
| SCHEMBL7729456 | 0.81 | EPHX2 (0.48) | POLBCYP1A2CYP3A4CYP2C19EPHX2 | |
| SCHEMBL7722280 | 0.79 | SCN9A (0.43) | POLBCYP1A2CYP3A4CYP2C19EPHX2 | |
| SCHEMBL7728565 | 0.77 | MEN1 (0.51) | POLBCYP1A2CYP3A4CYP2C19HDAC8 | |
| SCHEMBL7728568 | 0.77 | MEN1 (0.51) | POLBCYP1A2CYP3A4CYP2C19HDAC8 |
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 |