Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H2 | P55055 | 1/20 | 0.35 |
| ▸ | P2RX3 | P56373 | 1/20 | 0.34 |
| ▸ | FKBP1A | P62942 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | UCHL1 | P09936 | 1/20 | 0.32 |
| ▸ | TGM2 | P21980 | 2/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.31 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.31 |
| ▸ | RELA | Q04206 | 1/20 | 0.31 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.31 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL7729501 | 1.00 | NR1H2 (0.35) | NR1H2P2RX3FKBP1AMEN1KMT2A | |
| SCHEMBL15590886 | 0.93 | NR1H2 (0.36) | NR1H2P2RX3CYP1A2POLBCYP3A4 | |
| SCHEMBL6848454 | 0.93 | NR1H2 (0.36) | NR1H2P2RX3CYP1A2POLBCYP3A4 | |
| SCHEMBL30732551 | 0.93 | NR1H2 (0.36) | NR1H2P2RX3CYP1A2POLBCYP3A4 | |
| SCHEMBL6848461 | 0.93 | NR1H2 (0.36) | NR1H2P2RX3CYP1A2POLBCYP3A4 | |
| SCHEMBL30556108 | 0.88 | P2RX3 (0.39) | NR1H2P2RX3CYP1A2POLBCYP3A4 | |
| SCHEMBL15697413 | 0.88 | P2RX3 (0.39) | NR1H2P2RX3CYP1A2POLBCYP3A4 | |
| SCHEMBL15674375 | 0.88 | P2RX3 (0.39) | NR1H2P2RX3CYP1A2POLBCYP3A4 | |
| SCHEMBL15674373 | 0.88 | P2RX3 (0.39) | NR1H2P2RX3CYP1A2POLBCYP3A4 | |
| SCHEMBL85541 | 0.88 | P2RX3 (0.39) | NR1H2P2RX3CYP1A2POLBCYP3A4 |
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 2 patents. 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 |
| WO-2000001714-A1 | EFFLUX PUMP INHIBITORS | MICROCIDE PHARMACEUTICALS, INC. (US) | 2000-01-13 | — | — | WO | disclosed |