Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BTK | Q06187 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | AGTR2 | P50052 | 2/20 | 0.38 |
| ▸ | MMP2 | P08253 | 2/20 | 0.37 |
| ▸ | MMP9 | P14780 | 1/20 | 0.37 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | TLR2 | O60603 | 1/20 | 0.35 |
| ▸ | TLR1 | Q15399 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | ANPEP | P15144 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | CTSK | P43235 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL7726107 | 1.00 | BTK (0.40) | BTKSMN1; SMN2AGTR2MMP2MMP9 | |
| SCHEMBL7726834 | 1.00 | BTK (0.40) | BTKSMN1; SMN2AGTR2MMP2MMP9 | |
| SCHEMBL7728179 | 1.00 | BTK (0.40) | BTKSMN1; SMN2AGTR2MMP2MMP9 | |
| SCHEMBL7726096 | 1.00 | BTK (0.40) | BTKSMN1; SMN2AGTR2MMP2MMP9 | |
| SCHEMBL7727967 | 1.00 | BTK (0.40) | BTKSMN1; SMN2AGTR2MMP2MMP9 | |
| SCHEMBL7721954 | 1.00 | BTK (0.40) | BTKSMN1; SMN2AGTR2MMP2MMP9 | |
| SCHEMBL7726401 | 0.89 | MMP2 (0.39) | BTKSMN1; SMN2MMP2MMP9EPHX1 | |
| SCHEMBL7733815 | 0.89 | MMP2 (0.39) | BTKSMN1; SMN2MMP2MMP9EPHX1 | |
| SCHEMBL7733819 | 0.89 | MMP2 (0.39) | BTKSMN1; SMN2MMP2MMP9EPHX1 | |
| SCHEMBL7726398 | 0.89 | MMP2 (0.39) | BTKSMN1; SMN2MMP2MMP9EPHX1 |
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 |